6-amino-3,4-dihydro-1H-quinolin-2-one;cyclopropanamine;6-[[4-(cyclopropylamino)-1,3,5-triazin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;2,4-dichloropyrimidine;bis(N-ethyl-N-propan-2-ylpropan-2-amine)

C47H73Cl2N13O2 — CID 159862371

IUPAC6-amino-3,4-dihydro-1H-quinolin-2-one;cyclopropanamine;6-[[4-(cyclopropylamino)-1,3,5-triazin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;2,4-dichloropyrimidine;bis(N-ethyl-N-propan-2-ylpropan-2-amine)
SMILESCCN(C(C)C)C(C)C.CCN(C(C)C)C(C)C.Clc1ccnc(Cl)n1.NC1CC1.Nc1ccc2c(c1)CCC(=O)N2.O=C1CCc2cc(Nc3ncnc(NC4CC4)n3)ccc2N1
InChIInChI=1S/C15H16N6O.C9H10N2O.2C8H19N.C4H2Cl2N2.C3H7N/c22-13-6-1-9-7-11(4-5-12(9)20-13)19-15-17-8-16-14(21-15)18-10-2-3-10;10-7-2-3-8-6(5-7)1-4-9(12)11-8;2*1-6-9(7(2)3)8(4)5;5-3-1-2-7-4(6)8-3;4-3-1-2-3/h4-5,7-8,10H,1-3,6H2,(H,20,22)(H2,16,17,18,19,21);2-3,5H,1,4,10H2,(H,11,12);2*7-8H,6H2,1-5H3;1-2H;3H,1-2,4H2
InChIKeyNRHRGWILRDHZMP-UHFFFAOYSA-N
MW923.10 g/mol
LogP9.37
Rot. Bonds10

About 6-amino-3,4-dihydro-1H-quinolin-2-one;cyclopropanamine;6-[[4-(cyclopropylamino)-1,3,5-triazin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;2,4-dichloropyrimidine;bis(N-ethyl-N-propan-2-ylpropan-2-amine)

6-amino-3,4-dihydro-1H-quinolin-2-one;cyclopropanamine;6-[[4-(cyclopropylamino)-1,3,5-triazin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;2,4-dichloropyrimidine;bis(N-ethyl-N-propan-2-ylpropan-2-amine) (PubChem CID 159862371) has the molecular formula C47H73Cl2N13O2 and a molecular weight of 923.10 g/mol. Its IUPAC name is 6-amino-3,4-dihydro-1H-quinolin-2-one;cyclopropanamine;6-[[4-(cyclopropylamino)-1,3,5-triazin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;2,4-dichloropyrimidine;bis(N-ethyl-N-propan-2-ylpropan-2-amine).

Molecular Properties

Compound Name6-amino-3,4-dihydro-1H-quinolin-2-one;cyclopropanamine;6-[[4-(cyclopropylamino)-1,3,5-triazin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;2,4-dichloropyrimidine;bis(N-ethyl-N-propan-2-ylpropan-2-amine)
PubChem CID159862371
Molecular FormulaC47H73Cl2N13O2
Molecular Weight923.10 g/mol
Exact Mass921.54
IUPAC Name6-amino-3,4-dihydro-1H-quinolin-2-one;cyclopropanamine;6-[[4-(cyclopropylamino)-1,3,5-triazin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;2,4-dichloropyrimidine;bis(N-ethyl-N-propan-2-ylpropan-2-amine)
SMILESCCN(C(C)C)C(C)C.CCN(C(C)C)C(C)C.Clc1ccnc(Cl)n1.NC1CC1.Nc1ccc2c(c1)CCC(=O)N2.O=C1CCc2cc(Nc3ncnc(NC4CC4)n3)ccc2N1
InChIInChI=1S/C15H16N6O.C9H10N2O.2C8H19N.C4H2Cl2N2.C3H7N/c22-13-6-1-9-7-11(4-5-12(9)20-13)19-15-17-8-16-14(21-15)18-10-2-3-10;10-7-2-3-8-6(5-7)1-4-9(12)11-8;2*1-6-9(7(2)3)8(4)5;5-3-1-2-7-4(6)8-3;4-3-1-2-3/h4-5,7-8,10H,1-3,6H2,(H,20,22)(H2,16,17,18,19,21);2-3,5H,1,4,10H2,(H,11,12);2*7-8H,6H2,1-5H3;1-2H;3H,1-2,4H2
InChIKeyNRHRGWILRDHZMP-UHFFFAOYSA-N
XLogP9.37
TPSA205.23 Ų
H-Bond Donors6
H-Bond Acceptors13
Rotatable Bonds10
Heavy Atoms64
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 500923.10
LogP ≤ 59.37
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1013

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze 6-amino-3,4-dihydro-1H-quinolin-2-one;cyclopropanamine;6-[[4-(cyclopropylamino)-1,3,5-triazin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;2,4-dichloropyrimidine;bis(N-ethyl-N-propan-2-ylpropan-2-amine) 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

6-[(4-chloro-5-methylpyrimidin-2-yl)amino]-3,4-dihydro-1H-quinolin-2-one;ethylhydrazine;6-[[4-(2-ethylhydrazinyl)-5-methylpyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;N-ethyl-N-propan-2-ylpropan-2-amine
CID 158282611
6-[(3-aminocyclobutyl)amino]-3,4-dihydro-1H-quinolin-2-one
CID 80560774
2-N-(4-aminophenyl)-4-N-cyclopropyl-5-methylpyrimidine-2,4-diamine;cyclopropanecarbonyl chloride;N-(cyclopropanecarbonyl)-N-[4-[[4-(cyclopropylamino)-5-methylpyrimidin-2-yl]amino]phenyl]cyclopropanecarboxamide;N-ethyl-N-propan-2-ylpropan-2-amine
CID 158050445
4-[[5-methyl-4-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)amino]pyrimidin-2-yl]amino]benzenesulfonamide
CID 67046818
6-(cyclopropylmethylamino)-3,4-dihydro-1H-quinolin-2-one
CID 43738023
6-[(4,4-dimethylcycloheptyl)amino]-3,4-dihydro-1H-quinolin-2-one
CID 65083527
6-[[2-(1,3-benzodioxol-5-ylamino)-5-methylpyrimidin-4-yl]amino]-3,4-dihydro-1H-quinolin-2-one;6-[[4-(1,3-benzodioxol-5-ylamino)-5-methylpyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;2-N,4-N-bis(1,3-benzodioxol-5-yl)-5-methylpyrimidine-2,4-diamine
CID 160708060
6-(3-methylbutan-2-ylamino)-3,4-dihydro-1H-quinolin-2-one
CID 43737992
6-(1-methylsulfonylpropan-2-ylamino)-3,4-dihydro-1H-quinolin-2-one
CID 64629940
6-[1-(4-methyl-2-pyridinyl)ethylamino]-3,4-dihydro-1H-quinolin-2-one
CID 126801805
6-[[4-(oxetan-3-ylamino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one
CID 118906125
2-chloro-4-(cyclopropylamino)pyrimidine-5-carboxylic acid;cyclopropanamine;2,4-dichloropyrimidine-5-carboxylic acid;N-ethyl-N-propan-2-ylpropan-2-amine
CID 158603759

Frequently Asked Questions

What is the IUPAC name of 6-amino-3,4-dihydro-1H-quinolin-2-one;cyclopropanamine;6-[[4-(cyclopropylamino)-1,3,5-triazin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;2,4-dichloropyrimidine;bis(N-ethyl-N-propan-2-ylpropan-2-amine)?
The IUPAC name of 6-amino-3,4-dihydro-1H-quinolin-2-one;cyclopropanamine;6-[[4-(cyclopropylamino)-1,3,5-triazin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;2,4-dichloropyrimidine;bis(N-ethyl-N-propan-2-ylpropan-2-amine) (CID 159862371) is 6-amino-3,4-dihydro-1H-quinolin-2-one;cyclopropanamine;6-[[4-(cyclopropylamino)-1,3,5-triazin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;2,4-dichloropyrimidine;bis(N-ethyl-N-propan-2-ylpropan-2-amine).
What is the SMILES notation for 6-amino-3,4-dihydro-1H-quinolin-2-one;cyclopropanamine;6-[[4-(cyclopropylamino)-1,3,5-triazin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;2,4-dichloropyrimidine;bis(N-ethyl-N-propan-2-ylpropan-2-amine)?
The canonical SMILES for 6-amino-3,4-dihydro-1H-quinolin-2-one;cyclopropanamine;6-[[4-(cyclopropylamino)-1,3,5-triazin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;2,4-dichloropyrimidine;bis(N-ethyl-N-propan-2-ylpropan-2-amine) is CCN(C(C)C)C(C)C.CCN(C(C)C)C(C)C.Clc1ccnc(Cl)n1.NC1CC1.Nc1ccc2c(c1)CCC(=O)N2.O=C1CCc2cc(Nc3ncnc(NC4CC4)n3)ccc2N1.
What is the InChIKey of 6-amino-3,4-dihydro-1H-quinolin-2-one;cyclopropanamine;6-[[4-(cyclopropylamino)-1,3,5-triazin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;2,4-dichloropyrimidine;bis(N-ethyl-N-propan-2-ylpropan-2-amine)?
The InChIKey is NRHRGWILRDHZMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N6O.C9H10N2O.2C8H19N.C4H2Cl2N2.C3H7N/c22-13-6-1-9-7-11(4-5-12(9)20-13)19-15-17-8-16-14(21-15)18-10-2-3-10;10-7-2-3-8-6(5-7)1-4-9(12)11-8;2*1-6-9(7(2)3)8(4)5;5-3-1-2-7-4(6)8-3;4-3-1-2-3/h4-5,7-8,10H,1-3,6H2,(H,20,22)(H2,16,17,18,19,21);2-3,5H,1,4,10H2,(H,11,12);2*7-8H,6H2,1-5H3;1-2H;3H,1-2,4H2.
What are the key properties of 6-amino-3,4-dihydro-1H-quinolin-2-one;cyclopropanamine;6-[[4-(cyclopropylamino)-1,3,5-triazin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;2,4-dichloropyrimidine;bis(N-ethyl-N-propan-2-ylpropan-2-amine)?
6-amino-3,4-dihydro-1H-quinolin-2-one;cyclopropanamine;6-[[4-(cyclopropylamino)-1,3,5-triazin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;2,4-dichloropyrimidine;bis(N-ethyl-N-propan-2-ylpropan-2-amine) has a molecular weight of 923.10 g/mol, XLogP of 9.37, 10 rotatable bonds, 6 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-3,4-dihydro-1H-quinolin-2-one;cyclopropanamine;6-[[4-(cyclopropylamino)-1,3,5-triazin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;2,4-dichloropyrimidine;bis(N-ethyl-N-propan-2-ylpropan-2-amine) is sourced from PubChem (CID 159862371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).