N-(1-amino-2-cyclopropylpropan-2-yl)-2-cyclopropyl-6-methylquinoline-4-carboxamide

C20H25N3O — CID 119575448

IUPACN-(1-amino-2-cyclopropylpropan-2-yl)-2-cyclopropyl-6-methylquinoline-4-carboxamide
SMILESCc1ccc2nc(C3CC3)cc(C(=O)NC(C)(CN)C3CC3)c2c1
InChIInChI=1S/C20H25N3O/c1-12-3-8-17-15(9-12)16(10-18(22-17)13-4-5-13)19(24)23-20(2,11-21)14-6-7-14/h3,8-10,13-14H,4-7,11,21H2,1-2H3,(H,23,24)
InChIKeyAJVIFEYRHYZGTB-UHFFFAOYSA-N
MW323.44 g/mol
LogP3.28
Rot. Bonds5

About N-(1-amino-2-cyclopropylpropan-2-yl)-2-cyclopropyl-6-methylquinoline-4-carboxamide

N-(1-amino-2-cyclopropylpropan-2-yl)-2-cyclopropyl-6-methylquinoline-4-carboxamide (PubChem CID 119575448) has the molecular formula C20H25N3O and a molecular weight of 323.44 g/mol. Its IUPAC name is N-(1-amino-2-cyclopropylpropan-2-yl)-2-cyclopropyl-6-methylquinoline-4-carboxamide.

Molecular Properties

Compound NameN-(1-amino-2-cyclopropylpropan-2-yl)-2-cyclopropyl-6-methylquinoline-4-carboxamide
PubChem CID119575448
Molecular FormulaC20H25N3O
Molecular Weight323.44 g/mol
Exact Mass323.20
IUPAC NameN-(1-amino-2-cyclopropylpropan-2-yl)-2-cyclopropyl-6-methylquinoline-4-carboxamide
SMILESCc1ccc2nc(C3CC3)cc(C(=O)NC(C)(CN)C3CC3)c2c1
InChIInChI=1S/C20H25N3O/c1-12-3-8-17-15(9-12)16(10-18(22-17)13-4-5-13)19(24)23-20(2,11-21)14-6-7-14/h3,8-10,13-14H,4-7,11,21H2,1-2H3,(H,23,24)
InChIKeyAJVIFEYRHYZGTB-UHFFFAOYSA-N
XLogP3.28
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.44
LogP ≤ 53.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(2-cyclopropyl-6-methylquinoline-4-carbonyl)amino]-4-methoxy-3-methylbutanoic acid
CID 120532251
N-(3-aminopropyl)-2-cyclopropyl-6-methylquinoline-4-carboxamide;dihydrochloride
CID 119408408
N-(2-amino-1-cyclopropylethyl)-2-cyclopropyl-6-methylquinoline-4-carboxamide;dihydrochloride
CID 119617086
N-(1-amino-2-methylpropan-2-yl)-2-cyclopropylquinoline-4-carboxamide;dihydrochloride
CID 119522890
3-[(2-cyclopropyl-6-methylquinoline-4-carbonyl)amino]butanoic acid
CID 119347942
2-cyclopropyl-2-[(2-cyclopropyl-6-methylquinoline-4-carbonyl)amino]acetic acid
CID 120521154
2-[(2-cyclopropyl-6-fluoroquinoline-4-carbonyl)amino]-2-methylpropanoic acid
CID 120515978
2-cyclopropyl-6-methyl-N-(pyrrolidin-2-ylmethyl)quinoline-4-carboxamide;dihydrochloride
CID 119514049
N-(1-amino-2-cyclopropylpropan-2-yl)-7-fluoro-2-methylquinoline-3-carboxamide;dihydrochloride
CID 119573824
6-bromo-2-cyclopropylquinoline-4-carbohydrazide
CID 779890
2-cyclopropyl-6-methyl-N-[3-[[(S)-methylsulfinyl]methyl]phenyl]quinoline-4-carboxamide
CID 96522697
N-(1-amino-2-cyclopropylpropan-2-yl)-3,5-dimethylbenzamide;hydrochloride
CID 119573720

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2-cyclopropylpropan-2-yl)-2-cyclopropyl-6-methylquinoline-4-carboxamide?
The IUPAC name of N-(1-amino-2-cyclopropylpropan-2-yl)-2-cyclopropyl-6-methylquinoline-4-carboxamide (CID 119575448) is N-(1-amino-2-cyclopropylpropan-2-yl)-2-cyclopropyl-6-methylquinoline-4-carboxamide.
What is the SMILES notation for N-(1-amino-2-cyclopropylpropan-2-yl)-2-cyclopropyl-6-methylquinoline-4-carboxamide?
The canonical SMILES for N-(1-amino-2-cyclopropylpropan-2-yl)-2-cyclopropyl-6-methylquinoline-4-carboxamide is Cc1ccc2nc(C3CC3)cc(C(=O)NC(C)(CN)C3CC3)c2c1.
What is the InChIKey of N-(1-amino-2-cyclopropylpropan-2-yl)-2-cyclopropyl-6-methylquinoline-4-carboxamide?
The InChIKey is AJVIFEYRHYZGTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O/c1-12-3-8-17-15(9-12)16(10-18(22-17)13-4-5-13)19(24)23-20(2,11-21)14-6-7-14/h3,8-10,13-14H,4-7,11,21H2,1-2H3,(H,23,24).
What are the key properties of N-(1-amino-2-cyclopropylpropan-2-yl)-2-cyclopropyl-6-methylquinoline-4-carboxamide?
N-(1-amino-2-cyclopropylpropan-2-yl)-2-cyclopropyl-6-methylquinoline-4-carboxamide has a molecular weight of 323.44 g/mol, XLogP of 3.28, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2-cyclopropylpropan-2-yl)-2-cyclopropyl-6-methylquinoline-4-carboxamide is sourced from PubChem (CID 119575448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).