2-(2-aminopropylamino)quinoline-4-carboxamide

C13H16N4O — CID 63884670

IUPAC2-(2-aminopropylamino)quinoline-4-carboxamide
SMILESCC(N)CNc1cc(C(N)=O)c2ccccc2n1
InChIInChI=1S/C13H16N4O/c1-8(14)7-16-12-6-10(13(15)18)9-4-2-3-5-11(9)17-12/h2-6,8H,7,14H2,1H3,(H2,15,18)(H,16,17)
InChIKeyFUZBREMSQRZEPC-UHFFFAOYSA-N
MW244.30 g/mol
LogP1.09
Rot. Bonds4

About 2-(2-aminopropylamino)quinoline-4-carboxamide

2-(2-aminopropylamino)quinoline-4-carboxamide (PubChem CID 63884670) has the molecular formula C13H16N4O and a molecular weight of 244.30 g/mol. Its IUPAC name is 2-(2-aminopropylamino)quinoline-4-carboxamide.

Molecular Properties

Compound Name2-(2-aminopropylamino)quinoline-4-carboxamide
PubChem CID63884670
Molecular FormulaC13H16N4O
Molecular Weight244.30 g/mol
Exact Mass244.13
IUPAC Name2-(2-aminopropylamino)quinoline-4-carboxamide
SMILESCC(N)CNc1cc(C(N)=O)c2ccccc2n1
InChIInChI=1S/C13H16N4O/c1-8(14)7-16-12-6-10(13(15)18)9-4-2-3-5-11(9)17-12/h2-6,8H,7,14H2,1H3,(H2,15,18)(H,16,17)
InChIKeyFUZBREMSQRZEPC-UHFFFAOYSA-N
XLogP1.09
TPSA94.03 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.30
LogP ≤ 51.09
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-[[(4-carbamoylquinolin-2-yl)amino]methyl]butanoic acid
CID 65226681
2-[[(2S)-2-morpholin-4-ylpropyl]amino]quinoline-4-carboxamide
CID 94022811
ethyl 3-[(4-carbamoylquinolin-2-yl)amino]propanoate
CID 63885421
2-[(4-carbamoylquinolin-2-yl)amino]pentanoic acid
CID 63886576
3-[(4-carbamothioylquinolin-2-yl)amino]-2,2-dimethylpropanamide
CID 106277562
2-(piperidin-4-ylmethylamino)quinoline-4-carboxamide
CID 63883886
3-[(4-carbamothioylquinolin-2-yl)amino]-N,N-dimethylpropanamide
CID 63886113
2-(ethylamino)-N-pentan-2-ylquinoline-4-carboxamide
CID 62185765
2-(ethylamino)-N-(2-methylbutyl)quinoline-4-carboxamide
CID 62692096
2-(propan-2-ylamino)quinoline-4-carboxylic acid
CID 43154773
2-(3,3-dimethylbutan-2-ylamino)quinoline-4-carboxylic acid
CID 104828568
2-[(3-aminocyclobutyl)amino]quinoline-4-carboxamide
CID 63885442

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminopropylamino)quinoline-4-carboxamide?
The IUPAC name of 2-(2-aminopropylamino)quinoline-4-carboxamide (CID 63884670) is 2-(2-aminopropylamino)quinoline-4-carboxamide.
What is the SMILES notation for 2-(2-aminopropylamino)quinoline-4-carboxamide?
The canonical SMILES for 2-(2-aminopropylamino)quinoline-4-carboxamide is CC(N)CNc1cc(C(N)=O)c2ccccc2n1.
What is the InChIKey of 2-(2-aminopropylamino)quinoline-4-carboxamide?
The InChIKey is FUZBREMSQRZEPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O/c1-8(14)7-16-12-6-10(13(15)18)9-4-2-3-5-11(9)17-12/h2-6,8H,7,14H2,1H3,(H2,15,18)(H,16,17).
What are the key properties of 2-(2-aminopropylamino)quinoline-4-carboxamide?
2-(2-aminopropylamino)quinoline-4-carboxamide has a molecular weight of 244.30 g/mol, XLogP of 1.09, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminopropylamino)quinoline-4-carboxamide is sourced from PubChem (CID 63884670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).