(2R)-2-amino-2-cyclopropylacetamide;6-[[(1R)-2-amino-1-cyclopropyl-2-oxoethyl]amino]-5-fluoro-2-(quinolin-3-ylamino)pyridine-3-carboxamide;(2R)-2-[(6-chloro-5-cyano-3-fluoro-2-pyridinyl)amino]-2-cyclopropylacetamide;(2R)-2-[[5-cyano-3-fluoro-6-(quinolin-3-ylamino)-2-pyridinyl]amino]-2-cyclopropylacetamide;2,6-dichloro-5-fluoropyridine-3-carbonitrile;quinolin-3-amine;hydrochloride

C71H66Cl4F4N22O5 — CID 158729108

IUPAC(2R)-2-amino-2-cyclopropylacetamide;6-[[(1R)-2-amino-1-cyclopropyl-2-oxoethyl]amino]-5-fluoro-2-(quinolin-3-ylamino)pyridine-3-carboxamide;(2R)-2-[(6-chloro-5-cyano-3-fluoro-2-pyridinyl)amino]-2-cyclopropylacetamide;(2R)-2-[[5-cyano-3-fluoro-6-(quinolin-3-ylamino)-2-pyridinyl]amino]-2-cyclopropylacetamide;2,6-dichloro-5-fluoropyridine-3-carbonitrile;quinolin-3-amine;hydrochloride
SMILESCl.N#Cc1cc(F)c(Cl)nc1Cl.N#Cc1cc(F)c(N[C@@H](C(N)=O)C2CC2)nc1Cl.N#Cc1cc(F)c(N[C@@H](C(N)=O)C2CC2)nc1Nc1cnc2ccccc2c1.NC(=O)[C@H](N)C1CC1.NC(=O)c1cc(F)c(N[C@@H](C(N)=O)C2CC2)nc1Nc1cnc2ccccc2c1.Nc1cnc2ccccc2c1
InChIInChI=1S/C20H19FN6O2.C20H17FN6O.C11H10ClFN4O.C9H8N2.C6HCl2FN2.C5H10N2O.ClH/c21-14-8-13(17(22)28)19(27-20(14)26-16(18(23)29)10-5-6-10)25-12-7-11-3-1-2-4-15(11)24-9-12;21-15-8-13(9-22)19(27-20(15)26-17(18(23)28)11-5-6-11)25-14-7-12-3-1-2-4-16(12)24-10-14;12-9-6(4-14)3-7(13)11(17-9)16-8(10(15)18)5-1-2-5;10-8-5-7-3-1-2-4-9(7)11-6-8;7-5-3(2-10)1-4(9)6(8)11-5;6-4(5(7)8)3-1-2-3;/h1-4,7-10,16H,5-6H2,(H2,22,28)(H2,23,29)(H2,25,26,27);1-4,7-8,10-11,17H,5-6H2,(H2,23,28)(H2,25,26,27);3,5,8H,1-2H2,(H2,15,18)(H,16,17);1-6H,10H2;1H;3-4H,1-2,6H2,(H2,7,8);1H/t16-;17-;8-;;;4-;/m111..1./s1
InChIKeyHZAFGZOORIQOEG-FJXOBZDOSA-N
MW1525.26 g/mol
LogP10.62
Rot. Bonds19

About (2R)-2-amino-2-cyclopropylacetamide;6-[[(1R)-2-amino-1-cyclopropyl-2-oxoethyl]amino]-5-fluoro-2-(quinolin-3-ylamino)pyridine-3-carboxamide;(2R)-2-[(6-chloro-5-cyano-3-fluoro-2-pyridinyl)amino]-2-cyclopropylacetamide;(2R)-2-[[5-cyano-3-fluoro-6-(quinolin-3-ylamino)-2-pyridinyl]amino]-2-cyclopropylacetamide;2,6-dichloro-5-fluoropyridine-3-carbonitrile;quinolin-3-amine;hydrochloride

(2R)-2-amino-2-cyclopropylacetamide;6-[[(1R)-2-amino-1-cyclopropyl-2-oxoethyl]amino]-5-fluoro-2-(quinolin-3-ylamino)pyridine-3-carboxamide;(2R)-2-[(6-chloro-5-cyano-3-fluoro-2-pyridinyl)amino]-2-cyclopropylacetamide;(2R)-2-[[5-cyano-3-fluoro-6-(quinolin-3-ylamino)-2-pyridinyl]amino]-2-cyclopropylacetamide;2,6-dichloro-5-fluoropyridine-3-carbonitrile;quinolin-3-amine;hydrochloride (PubChem CID 158729108) has the molecular formula C71H66Cl4F4N22O5 and a molecular weight of 1525.26 g/mol. Its IUPAC name is (2R)-2-amino-2-cyclopropylacetamide;6-[[(1R)-2-amino-1-cyclopropyl-2-oxoethyl]amino]-5-fluoro-2-(quinolin-3-ylamino)pyridine-3-carboxamide;(2R)-2-[(6-chloro-5-cyano-3-fluoro-2-pyridinyl)amino]-2-cyclopropylacetamide;(2R)-2-[[5-cyano-3-fluoro-6-(quinolin-3-ylamino)-2-pyridinyl]amino]-2-cyclopropylacetamide;2,6-dichloro-5-fluoropyridine-3-carbonitrile;quinolin-3-amine;hydrochloride.

Molecular Properties

Compound Name(2R)-2-amino-2-cyclopropylacetamide;6-[[(1R)-2-amino-1-cyclopropyl-2-oxoethyl]amino]-5-fluoro-2-(quinolin-3-ylamino)pyridine-3-carboxamide;(2R)-2-[(6-chloro-5-cyano-3-fluoro-2-pyridinyl)amino]-2-cyclopropylacetamide;(2R)-2-[[5-cyano-3-fluoro-6-(quinolin-3-ylamino)-2-pyridinyl]amino]-2-cyclopropylacetamide;2,6-dichloro-5-fluoropyridine-3-carbonitrile;quinolin-3-amine;hydrochloride
PubChem CID158729108
Molecular FormulaC71H66Cl4F4N22O5
Molecular Weight1525.26 g/mol
Exact Mass1522.43
IUPAC Name(2R)-2-amino-2-cyclopropylacetamide;6-[[(1R)-2-amino-1-cyclopropyl-2-oxoethyl]amino]-5-fluoro-2-(quinolin-3-ylamino)pyridine-3-carboxamide;(2R)-2-[(6-chloro-5-cyano-3-fluoro-2-pyridinyl)amino]-2-cyclopropylacetamide;(2R)-2-[[5-cyano-3-fluoro-6-(quinolin-3-ylamino)-2-pyridinyl]amino]-2-cyclopropylacetamide;2,6-dichloro-5-fluoropyridine-3-carbonitrile;quinolin-3-amine;hydrochloride
SMILESCl.N#Cc1cc(F)c(Cl)nc1Cl.N#Cc1cc(F)c(N[C@@H](C(N)=O)C2CC2)nc1Cl.N#Cc1cc(F)c(N[C@@H](C(N)=O)C2CC2)nc1Nc1cnc2ccccc2c1.NC(=O)[C@H](N)C1CC1.NC(=O)c1cc(F)c(N[C@@H](C(N)=O)C2CC2)nc1Nc1cnc2ccccc2c1.Nc1cnc2ccccc2c1
InChIInChI=1S/C20H19FN6O2.C20H17FN6O.C11H10ClFN4O.C9H8N2.C6HCl2FN2.C5H10N2O.ClH/c21-14-8-13(17(22)28)19(27-20(14)26-16(18(23)29)10-5-6-10)25-12-7-11-3-1-2-4-15(11)24-9-12;21-15-8-13(9-22)19(27-20(15)26-17(18(23)28)11-5-6-11)25-14-7-12-3-1-2-4-16(12)24-10-14;12-9-6(4-14)3-7(13)11(17-9)16-8(10(15)18)5-1-2-5;10-8-5-7-3-1-2-4-9(7)11-6-8;7-5-3(2-10)1-4(9)6(8)11-5;6-4(5(7)8)3-1-2-3;/h1-4,7-10,16H,5-6H2,(H2,22,28)(H2,23,29)(H2,25,26,27);1-4,7-8,10-11,17H,5-6H2,(H2,23,28)(H2,25,26,27);3,5,8H,1-2H2,(H2,15,18)(H,16,17);1-6H,10H2;1H;3-4H,1-2,6H2,(H2,7,8);1H/t16-;17-;8-;;;4-;/m111..1./s1
InChIKeyHZAFGZOORIQOEG-FJXOBZDOSA-N
XLogP10.62
TPSA489.24 Ų
H-Bond Donors12
H-Bond Acceptors22
Rotatable Bonds19
Heavy Atoms106
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001525.26
LogP ≤ 510.62
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1022

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze (2R)-2-amino-2-cyclopropylacetamide;6-[[(1R)-2-amino-1-cyclopropyl-2-oxoethyl]amino]-5-fluoro-2-(quinolin-3-ylamino)pyridine-3-carboxamide;(2R)-2-[(6-chloro-5-cyano-3-fluoro-2-pyridinyl)amino]-2-cyclopropylacetamide;(2R)-2-[[5-cyano-3-fluoro-6-(quinolin-3-ylamino)-2-pyridinyl]amino]-2-cyclopropylacetamide;2,6-dichloro-5-fluoropyridine-3-carbonitrile;quinolin-3-amine;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-amino-5-[(3S)-4-[1-(2-amino-6-chloropyridine-3-carbonyl)piperidin-4-yl]-3-ethylpiperazin-1-yl]-N-cyclopropyl-6-methylpyrazine-2-carboxamide;3-amino-5-[(3S)-4-[1-(2-amino-6-chloropyridine-3-carbonyl)piperidin-4-yl]-3-ethylpiperazin-1-yl]-N-ethyl-6-methylpyrazine-2-carboxamide;3-amino-5-[(2R,5S)-4-[1-(2-amino-6-methylpyridine-3-carbonyl)piperidin-4-yl]-5-ethyl-2-methylpiperazin-1-yl]-6-chloro-N-cyclopropylpyrazine-2-carboxamide;5-[(3S)-4-[1-(2-amino-6-chloropyridine-3-carbonyl)piperidin-4-yl]-3-ethylpiperazin-1-yl]-6-(trifluoromethyl)pyrazine-2-carboxamide
CID 157503839
6-[[(1R,2R)-2-amino-3,3-difluorocyclohexyl]amino]-5-fluoro-2-(quinolin-6-ylamino)pyridine-3-carbonitrile;6-[[(1R,2R)-2-amino-3,3-difluorocyclohexyl]amino]-5-fluoro-2-(quinolin-6-ylamino)pyridine-3-carboxamide
CID 157927734
6-[(1-amino-1-oxobutan-2-yl)amino]-5-fluoro-2-(quinolin-3-ylamino)pyridine-3-carboxamide;bis(2-amino-4,4,4-trifluorobutanamide);2-amino-4,4,4-trifluorobutanoic acid;tert-butyl N-(1-amino-4,4,4-trifluoro-1-oxobutan-2-yl)carbamate;2-[(6-chloro-5-cyano-3-fluoro-2-pyridinyl)amino]butanamide;2-[[5-cyano-3-fluoro-6-(quinolin-3-ylamino)-2-pyridinyl]amino]butanamide;2,6-dichloro-5-fluoropyridine-3-carbonitrile;2-oxoboranylethynol;quinolin-3-amine;4,4,4-trifluoro-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid
CID 159847125
6-chloro-4-[(2,2-difluorocyclopentyl)amino]-N-methylpyridine-3-carboxamide;4-[(2,2-difluorocyclopentyl)amino]-N-methyl-6-(quinolin-2-ylamino)pyridine-3-carboxamide;quinolin-2-amine
CID 160078829
2-(pyridin-4-ylmethylamino)-N-quinolin-8-ylpyridine-3-carboxamide;2-(pyridin-4-ylmethylamino)-N-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide;hydrochloride
CID 160416765
3-amino-5-[(3S)-4-[1-(2-amino-6-chloropyridine-3-carbonyl)piperidin-4-yl]-3-ethylpiperazin-1-yl]-6-chloro-N-ethylpyrazine-2-carboxamide;3-amino-5-[(3S)-4-[1-(2-amino-6-chloropyridine-3-carbonyl)piperidin-4-yl]-3-ethylpiperazin-1-yl]-N-cyclopropyl-6-methylpyrazine-2-carboxamide;3-amino-5-[(2R,5S)-4-[1-(2-amino-6-methylpyridine-3-carbonyl)piperidin-4-yl]-5-ethyl-2-methylpiperazin-1-yl]-6-chloro-N-cyclopropylpyrazine-2-carboxamide;5-[(3S)-4-[1-(2-amino-6-chloropyridine-3-carbonyl)piperidin-4-yl]-3-ethylpiperazin-1-yl]-6-(trifluoromethyl)pyrazine-2-carboxamide
CID 160424754
[2-[[(5-Chloro-2-pyridinyl)amino]methyl]-4,4-difluoropiperidin-1-yl]-quinolin-8-ylmethanone
CID 160625467
4-amino-6-[[(1S)-1-[3-(6-amino-4-methyl-3-pyridinyl)-5-chloro-4-oxoquinazolin-2-yl]ethyl]amino]-2-methylpyrimidine-5-carbonitrile;4-amino-6-[[(S)-[5-chloro-8-fluoro-3-(5-fluoro-4-methyl-3-pyridinyl)-4-oxoquinazolin-2-yl]-cyclopropylmethyl]amino]-2-methylpyrimidine-5-carbonitrile;4-amino-6-[[(S)-(5-chloro-6-fluoro-4-oxo-3-pyridin-3-ylquinazolin-2-yl)-cyclopropylmethyl]amino]-2-methylpyrimidine-5-carbonitrile;4-amino-2-methyl-6-[[(1S)-1-[4-oxo-3-pyridin-3-yl-5-(trifluoromethyl)quinazolin-2-yl]ethyl]amino]pyrimidine-5-carbonitrile
CID 161162858
5-[[(1R,2R)-2-amino-3,3-difluorocyclohexyl]amino]-3-chloropyrazine-2-carbonitrile;5-[[(1R,2R)-2-amino-3,3-difluorocyclohexyl]amino]-3-(quinolin-6-ylamino)pyrazine-2-carbonitrile;5-[[(1R,2R)-2-amino-3,3-difluorocyclohexyl]amino]-3-(quinolin-6-ylamino)pyrazine-2-carboxamide;3,5-dichloropyrazine-2-carbonitrile;quinolin-6-amine;trans-(1R,2R)-3,3-difluorocyclohexane-1,2-diamine
CID 161429506
6-[[(1R,2R)-2-amino-3,3-difluorocyclohexyl]amino]-2-chloro-5-fluoropyridine-3-carbonitrile;6-[[(1R,2R)-2-amino-3,3-difluorocyclohexyl]amino]-5-fluoro-2-(quinolin-6-ylamino)pyridine-3-carbonitrile;6-[[(1R,2R)-2-amino-3,3-difluorocyclohexyl]amino]-5-fluoro-2-(quinolin-6-ylamino)pyridine-3-carboxamide;quinolin-6-amine
CID 161685350
5-[3-Chloro-8-phenyl-1-(pyridin-2-ylmethylamino)isoquinolin-4-yl]pyridine-3-carbonitrile;5-[3-chloro-8-phenyl-1-(pyridin-2-ylmethylamino)isoquinolin-4-yl]pyridine-3-carboxamide
CID 157138411
6-chloro-2-[2-(3-fluorophenyl)ethylamino]-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide;6-cyano-2-[2-(3-fluorophenyl)ethylamino]-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide
CID 157324508

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-2-cyclopropylacetamide;6-[[(1R)-2-amino-1-cyclopropyl-2-oxoethyl]amino]-5-fluoro-2-(quinolin-3-ylamino)pyridine-3-carboxamide;(2R)-2-[(6-chloro-5-cyano-3-fluoro-2-pyridinyl)amino]-2-cyclopropylacetamide;(2R)-2-[[5-cyano-3-fluoro-6-(quinolin-3-ylamino)-2-pyridinyl]amino]-2-cyclopropylacetamide;2,6-dichloro-5-fluoropyridine-3-carbonitrile;quinolin-3-amine;hydrochloride?
The IUPAC name of (2R)-2-amino-2-cyclopropylacetamide;6-[[(1R)-2-amino-1-cyclopropyl-2-oxoethyl]amino]-5-fluoro-2-(quinolin-3-ylamino)pyridine-3-carboxamide;(2R)-2-[(6-chloro-5-cyano-3-fluoro-2-pyridinyl)amino]-2-cyclopropylacetamide;(2R)-2-[[5-cyano-3-fluoro-6-(quinolin-3-ylamino)-2-pyridinyl]amino]-2-cyclopropylacetamide;2,6-dichloro-5-fluoropyridine-3-carbonitrile;quinolin-3-amine;hydrochloride (CID 158729108) is (2R)-2-amino-2-cyclopropylacetamide;6-[[(1R)-2-amino-1-cyclopropyl-2-oxoethyl]amino]-5-fluoro-2-(quinolin-3-ylamino)pyridine-3-carboxamide;(2R)-2-[(6-chloro-5-cyano-3-fluoro-2-pyridinyl)amino]-2-cyclopropylacetamide;(2R)-2-[[5-cyano-3-fluoro-6-(quinolin-3-ylamino)-2-pyridinyl]amino]-2-cyclopropylacetamide;2,6-dichloro-5-fluoropyridine-3-carbonitrile;quinolin-3-amine;hydrochloride.
What is the SMILES notation for (2R)-2-amino-2-cyclopropylacetamide;6-[[(1R)-2-amino-1-cyclopropyl-2-oxoethyl]amino]-5-fluoro-2-(quinolin-3-ylamino)pyridine-3-carboxamide;(2R)-2-[(6-chloro-5-cyano-3-fluoro-2-pyridinyl)amino]-2-cyclopropylacetamide;(2R)-2-[[5-cyano-3-fluoro-6-(quinolin-3-ylamino)-2-pyridinyl]amino]-2-cyclopropylacetamide;2,6-dichloro-5-fluoropyridine-3-carbonitrile;quinolin-3-amine;hydrochloride?
The canonical SMILES for (2R)-2-amino-2-cyclopropylacetamide;6-[[(1R)-2-amino-1-cyclopropyl-2-oxoethyl]amino]-5-fluoro-2-(quinolin-3-ylamino)pyridine-3-carboxamide;(2R)-2-[(6-chloro-5-cyano-3-fluoro-2-pyridinyl)amino]-2-cyclopropylacetamide;(2R)-2-[[5-cyano-3-fluoro-6-(quinolin-3-ylamino)-2-pyridinyl]amino]-2-cyclopropylacetamide;2,6-dichloro-5-fluoropyridine-3-carbonitrile;quinolin-3-amine;hydrochloride is Cl.N#Cc1cc(F)c(Cl)nc1Cl.N#Cc1cc(F)c(N[C@@H](C(N)=O)C2CC2)nc1Cl.N#Cc1cc(F)c(N[C@@H](C(N)=O)C2CC2)nc1Nc1cnc2ccccc2c1.NC(=O)[C@H](N)C1CC1.NC(=O)c1cc(F)c(N[C@@H](C(N)=O)C2CC2)nc1Nc1cnc2ccccc2c1.Nc1cnc2ccccc2c1.
What is the InChIKey of (2R)-2-amino-2-cyclopropylacetamide;6-[[(1R)-2-amino-1-cyclopropyl-2-oxoethyl]amino]-5-fluoro-2-(quinolin-3-ylamino)pyridine-3-carboxamide;(2R)-2-[(6-chloro-5-cyano-3-fluoro-2-pyridinyl)amino]-2-cyclopropylacetamide;(2R)-2-[[5-cyano-3-fluoro-6-(quinolin-3-ylamino)-2-pyridinyl]amino]-2-cyclopropylacetamide;2,6-dichloro-5-fluoropyridine-3-carbonitrile;quinolin-3-amine;hydrochloride?
The InChIKey is HZAFGZOORIQOEG-FJXOBZDOSA-N. The full InChI is InChI=1S/C20H19FN6O2.C20H17FN6O.C11H10ClFN4O.C9H8N2.C6HCl2FN2.C5H10N2O.ClH/c21-14-8-13(17(22)28)19(27-20(14)26-16(18(23)29)10-5-6-10)25-12-7-11-3-1-2-4-15(11)24-9-12;21-15-8-13(9-22)19(27-20(15)26-17(18(23)28)11-5-6-11)25-14-7-12-3-1-2-4-16(12)24-10-14;12-9-6(4-14)3-7(13)11(17-9)16-8(10(15)18)5-1-2-5;10-8-5-7-3-1-2-4-9(7)11-6-8;7-5-3(2-10)1-4(9)6(8)11-5;6-4(5(7)8)3-1-2-3;/h1-4,7-10,16H,5-6H2,(H2,22,28)(H2,23,29)(H2,25,26,27);1-4,7-8,10-11,17H,5-6H2,(H2,23,28)(H2,25,26,27);3,5,8H,1-2H2,(H2,15,18)(H,16,17);1-6H,10H2;1H;3-4H,1-2,6H2,(H2,7,8);1H/t16-;17-;8-;;;4-;/m111..1./s1.
What are the key properties of (2R)-2-amino-2-cyclopropylacetamide;6-[[(1R)-2-amino-1-cyclopropyl-2-oxoethyl]amino]-5-fluoro-2-(quinolin-3-ylamino)pyridine-3-carboxamide;(2R)-2-[(6-chloro-5-cyano-3-fluoro-2-pyridinyl)amino]-2-cyclopropylacetamide;(2R)-2-[[5-cyano-3-fluoro-6-(quinolin-3-ylamino)-2-pyridinyl]amino]-2-cyclopropylacetamide;2,6-dichloro-5-fluoropyridine-3-carbonitrile;quinolin-3-amine;hydrochloride?
(2R)-2-amino-2-cyclopropylacetamide;6-[[(1R)-2-amino-1-cyclopropyl-2-oxoethyl]amino]-5-fluoro-2-(quinolin-3-ylamino)pyridine-3-carboxamide;(2R)-2-[(6-chloro-5-cyano-3-fluoro-2-pyridinyl)amino]-2-cyclopropylacetamide;(2R)-2-[[5-cyano-3-fluoro-6-(quinolin-3-ylamino)-2-pyridinyl]amino]-2-cyclopropylacetamide;2,6-dichloro-5-fluoropyridine-3-carbonitrile;quinolin-3-amine;hydrochloride has a molecular weight of 1525.26 g/mol, XLogP of 10.62, 19 rotatable bonds, 12 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-2-cyclopropylacetamide;6-[[(1R)-2-amino-1-cyclopropyl-2-oxoethyl]amino]-5-fluoro-2-(quinolin-3-ylamino)pyridine-3-carboxamide;(2R)-2-[(6-chloro-5-cyano-3-fluoro-2-pyridinyl)amino]-2-cyclopropylacetamide;(2R)-2-[[5-cyano-3-fluoro-6-(quinolin-3-ylamino)-2-pyridinyl]amino]-2-cyclopropylacetamide;2,6-dichloro-5-fluoropyridine-3-carbonitrile;quinolin-3-amine;hydrochloride is sourced from PubChem (CID 158729108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).