4-amino-N-(3-methoxycyclopentyl)quinoline-2-carboxamide

C16H19N3O2 — CID 103099401

IUPAC4-amino-N-(3-methoxycyclopentyl)quinoline-2-carboxamide
SMILESCOC1CCC(NC(=O)c2cc(N)c3ccccc3n2)C1
InChIInChI=1S/C16H19N3O2/c1-21-11-7-6-10(8-11)18-16(20)15-9-13(17)12-4-2-3-5-14(12)19-15/h2-5,9-11H,6-8H2,1H3,(H2,17,19)(H,18,20)
InChIKeyXUQQJTIVAQVJAY-UHFFFAOYSA-N
MW285.35 g/mol
LogP2.11
Rot. Bonds3

About 4-amino-N-(3-methoxycyclopentyl)quinoline-2-carboxamide

4-amino-N-(3-methoxycyclopentyl)quinoline-2-carboxamide (PubChem CID 103099401) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is 4-amino-N-(3-methoxycyclopentyl)quinoline-2-carboxamide.

Molecular Properties

Compound Name4-amino-N-(3-methoxycyclopentyl)quinoline-2-carboxamide
PubChem CID103099401
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC Name4-amino-N-(3-methoxycyclopentyl)quinoline-2-carboxamide
SMILESCOC1CCC(NC(=O)c2cc(N)c3ccccc3n2)C1
InChIInChI=1S/C16H19N3O2/c1-21-11-7-6-10(8-11)18-16(20)15-9-13(17)12-4-2-3-5-14(12)19-15/h2-5,9-11H,6-8H2,1H3,(H2,17,19)(H,18,20)
InChIKeyXUQQJTIVAQVJAY-UHFFFAOYSA-N
XLogP2.11
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-N-piperidin-4-ylquinoline-2-carboxamide
CID 71141710
4-amino-N-cyclopentyloxyquinoline-2-carboxamide
CID 83216868
4-chloro-N-(3-methylcyclopentyl)quinoline-2-carboxamide
CID 114545564
4-amino-N-(1-methyl-2-oxopyrrolidin-3-yl)quinoline-2-carboxamide
CID 103827378
4-(methylamino)-N-(3-methylcyclopentyl)quinoline-2-carboxamide
CID 114540556
4-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]quinoline-2-carboxamide
CID 63375694
4-amino-N-[2-(hydroxymethyl)cyclopentyl]quinoline-2-carboxamide
CID 103856999
4-amino-N-carbamoylquinoline-2-carboxamide
CID 18770494
3-amino-4-fluoro-N-(3-methoxycyclopentyl)benzamide
CID 114117879
4-amino-N-(2-butoxyethyl)quinoline-2-carboxamide
CID 63375414
4-amino-N-(2-cyclopropyl-2-hydroxyethyl)quinoline-2-carboxamide
CID 115485639
2-(aminomethyl)-N-(3-methoxycyclopentyl)-1,3-thiazole-4-carboxamide
CID 114118049

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(3-methoxycyclopentyl)quinoline-2-carboxamide?
The IUPAC name of 4-amino-N-(3-methoxycyclopentyl)quinoline-2-carboxamide (CID 103099401) is 4-amino-N-(3-methoxycyclopentyl)quinoline-2-carboxamide.
What is the SMILES notation for 4-amino-N-(3-methoxycyclopentyl)quinoline-2-carboxamide?
The canonical SMILES for 4-amino-N-(3-methoxycyclopentyl)quinoline-2-carboxamide is COC1CCC(NC(=O)c2cc(N)c3ccccc3n2)C1.
What is the InChIKey of 4-amino-N-(3-methoxycyclopentyl)quinoline-2-carboxamide?
The InChIKey is XUQQJTIVAQVJAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-21-11-7-6-10(8-11)18-16(20)15-9-13(17)12-4-2-3-5-14(12)19-15/h2-5,9-11H,6-8H2,1H3,(H2,17,19)(H,18,20).
What are the key properties of 4-amino-N-(3-methoxycyclopentyl)quinoline-2-carboxamide?
4-amino-N-(3-methoxycyclopentyl)quinoline-2-carboxamide has a molecular weight of 285.35 g/mol, XLogP of 2.11, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(3-methoxycyclopentyl)quinoline-2-carboxamide is sourced from PubChem (CID 103099401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).