4-amino-N-[1-(dimethylamino)propan-2-yl]quinoline-2-carboxamide

C15H20N4O — CID 82945143

IUPAC4-amino-N-[1-(dimethylamino)propan-2-yl]quinoline-2-carboxamide
SMILESCC(CN(C)C)NC(=O)c1cc(N)c2ccccc2n1
InChIInChI=1S/C15H20N4O/c1-10(9-19(2)3)17-15(20)14-8-12(16)11-6-4-5-7-13(11)18-14/h4-8,10H,9H2,1-3H3,(H2,16,18)(H,17,20)
InChIKeyVJDLBDAYTOZXBY-UHFFFAOYSA-N
MW272.35 g/mol
LogP1.50
Rot. Bonds4

About 4-amino-N-[1-(dimethylamino)propan-2-yl]quinoline-2-carboxamide

4-amino-N-[1-(dimethylamino)propan-2-yl]quinoline-2-carboxamide (PubChem CID 82945143) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is 4-amino-N-[1-(dimethylamino)propan-2-yl]quinoline-2-carboxamide.

Molecular Properties

Compound Name4-amino-N-[1-(dimethylamino)propan-2-yl]quinoline-2-carboxamide
PubChem CID82945143
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC Name4-amino-N-[1-(dimethylamino)propan-2-yl]quinoline-2-carboxamide
SMILESCC(CN(C)C)NC(=O)c1cc(N)c2ccccc2n1
InChIInChI=1S/C15H20N4O/c1-10(9-19(2)3)17-15(20)14-8-12(16)11-6-4-5-7-13(11)18-14/h4-8,10H,9H2,1-3H3,(H2,16,18)(H,17,20)
InChIKeyVJDLBDAYTOZXBY-UHFFFAOYSA-N
XLogP1.50
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-N-(4-methylpentan-2-yl)quinoline-2-carboxamide
CID 63375215
N-[1-(dimethylamino)propan-2-yl]-4-(methylamino)quinoline-2-carboxamide
CID 82940781
4-amino-N-(4-amino-4-oxobutan-2-yl)quinoline-2-carboxamide
CID 115751990
4-amino-N-(4-methylsulfanylbutan-2-yl)quinoline-2-carboxamide
CID 115751987
4-amino-N-(2-hydroxypropyl)quinoline-2-carboxamide
CID 113319901
2-amino-N-[1-(dimethylamino)propan-2-yl]benzamide
CID 82946038
4-amino-N-carbamoylquinoline-2-carboxamide
CID 18770494
4-amino-N-[2-(methylamino)-2-oxoethyl]quinoline-2-carboxamide
CID 63375489
4-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]quinoline-2-carboxamide
CID 63375694
4-amino-N-methyl-N-phenylquinoline-2-carboxamide
CID 63375205
4-amino-N-(2-amino-2-oxoethyl)-N-methylquinoline-2-carboxamide
CID 115349399
4-aminoquinoline-2-carboxylic acid;hydrochloride
CID 171379335

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[1-(dimethylamino)propan-2-yl]quinoline-2-carboxamide?
The IUPAC name of 4-amino-N-[1-(dimethylamino)propan-2-yl]quinoline-2-carboxamide (CID 82945143) is 4-amino-N-[1-(dimethylamino)propan-2-yl]quinoline-2-carboxamide.
What is the SMILES notation for 4-amino-N-[1-(dimethylamino)propan-2-yl]quinoline-2-carboxamide?
The canonical SMILES for 4-amino-N-[1-(dimethylamino)propan-2-yl]quinoline-2-carboxamide is CC(CN(C)C)NC(=O)c1cc(N)c2ccccc2n1.
What is the InChIKey of 4-amino-N-[1-(dimethylamino)propan-2-yl]quinoline-2-carboxamide?
The InChIKey is VJDLBDAYTOZXBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c1-10(9-19(2)3)17-15(20)14-8-12(16)11-6-4-5-7-13(11)18-14/h4-8,10H,9H2,1-3H3,(H2,16,18)(H,17,20).
What are the key properties of 4-amino-N-[1-(dimethylamino)propan-2-yl]quinoline-2-carboxamide?
4-amino-N-[1-(dimethylamino)propan-2-yl]quinoline-2-carboxamide has a molecular weight of 272.35 g/mol, XLogP of 1.50, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[1-(dimethylamino)propan-2-yl]quinoline-2-carboxamide is sourced from PubChem (CID 82945143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).