2-(3-aminocyclopentyl)oxyquinoline-4-carboxamide

C15H17N3O2 — CID 79464571

IUPAC2-(3-aminocyclopentyl)oxyquinoline-4-carboxamide
SMILESNC(=O)c1cc(OC2CCC(N)C2)nc2ccccc12
InChIInChI=1S/C15H17N3O2/c16-9-5-6-10(7-9)20-14-8-12(15(17)19)11-3-1-2-4-13(11)18-14/h1-4,8-10H,5-7,16H2,(H2,17,19)
InChIKeyVSCZJWRYXLTXJG-UHFFFAOYSA-N
MW271.32 g/mol
LogP1.59
Rot. Bonds3

About 2-(3-aminocyclopentyl)oxyquinoline-4-carboxamide

2-(3-aminocyclopentyl)oxyquinoline-4-carboxamide (PubChem CID 79464571) has the molecular formula C15H17N3O2 and a molecular weight of 271.32 g/mol. Its IUPAC name is 2-(3-aminocyclopentyl)oxyquinoline-4-carboxamide.

Molecular Properties

Compound Name2-(3-aminocyclopentyl)oxyquinoline-4-carboxamide
PubChem CID79464571
Molecular FormulaC15H17N3O2
Molecular Weight271.32 g/mol
Exact Mass271.13
IUPAC Name2-(3-aminocyclopentyl)oxyquinoline-4-carboxamide
SMILESNC(=O)c1cc(OC2CCC(N)C2)nc2ccccc12
InChIInChI=1S/C15H17N3O2/c16-9-5-6-10(7-9)20-14-8-12(15(17)19)11-3-1-2-4-13(11)18-14/h1-4,8-10H,5-7,16H2,(H2,17,19)
InChIKeyVSCZJWRYXLTXJG-UHFFFAOYSA-N
XLogP1.59
TPSA91.23 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(3-aminocyclopentyl)oxyquinoline-4-carboxamide?
The IUPAC name of 2-(3-aminocyclopentyl)oxyquinoline-4-carboxamide (CID 79464571) is 2-(3-aminocyclopentyl)oxyquinoline-4-carboxamide.
What is the SMILES notation for 2-(3-aminocyclopentyl)oxyquinoline-4-carboxamide?
The canonical SMILES for 2-(3-aminocyclopentyl)oxyquinoline-4-carboxamide is NC(=O)c1cc(OC2CCC(N)C2)nc2ccccc12.
What is the InChIKey of 2-(3-aminocyclopentyl)oxyquinoline-4-carboxamide?
The InChIKey is VSCZJWRYXLTXJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O2/c16-9-5-6-10(7-9)20-14-8-12(15(17)19)11-3-1-2-4-13(11)18-14/h1-4,8-10H,5-7,16H2,(H2,17,19).
What are the key properties of 2-(3-aminocyclopentyl)oxyquinoline-4-carboxamide?
2-(3-aminocyclopentyl)oxyquinoline-4-carboxamide has a molecular weight of 271.32 g/mol, XLogP of 1.59, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-aminocyclopentyl)oxyquinoline-4-carboxamide is sourced from PubChem (CID 79464571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).