4-amino-N-cyclopentyloxyquinoline-2-carboxamide

C15H17N3O2 — CID 83216868

IUPAC4-amino-N-cyclopentyloxyquinoline-2-carboxamide
SMILESNc1cc(C(=O)NOC2CCCC2)nc2ccccc12
InChIInChI=1S/C15H17N3O2/c16-12-9-14(17-13-8-4-3-7-11(12)13)15(19)18-20-10-5-1-2-6-10/h3-4,7-10H,1-2,5-6H2,(H2,16,17)(H,18,19)
InChIKeyPKJOOBYKRYNSFZ-UHFFFAOYSA-N
MW271.32 g/mol
LogP2.42
Rot. Bonds3

About 4-amino-N-cyclopentyloxyquinoline-2-carboxamide

4-amino-N-cyclopentyloxyquinoline-2-carboxamide (PubChem CID 83216868) has the molecular formula C15H17N3O2 and a molecular weight of 271.32 g/mol. Its IUPAC name is 4-amino-N-cyclopentyloxyquinoline-2-carboxamide.

Molecular Properties

Compound Name4-amino-N-cyclopentyloxyquinoline-2-carboxamide
PubChem CID83216868
Molecular FormulaC15H17N3O2
Molecular Weight271.32 g/mol
Exact Mass271.13
IUPAC Name4-amino-N-cyclopentyloxyquinoline-2-carboxamide
SMILESNc1cc(C(=O)NOC2CCCC2)nc2ccccc12
InChIInChI=1S/C15H17N3O2/c16-12-9-14(17-13-8-4-3-7-11(12)13)15(19)18-20-10-5-1-2-6-10/h3-4,7-10H,1-2,5-6H2,(H2,16,17)(H,18,19)
InChIKeyPKJOOBYKRYNSFZ-UHFFFAOYSA-N
XLogP2.42
TPSA77.24 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 ≤ 52.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

4-amino-N-(3-methoxycyclopentyl)quinoline-2-carboxamide
CID 103099401
4-amino-N-carbamoylquinoline-2-carboxamide
CID 18770494
2-cyclobutylethyl 4-aminoquinoline-2-carboxylate
CID 106202811
4-amino-N-piperidin-4-ylquinoline-2-carboxamide
CID 71141710
4-amino-N-[2-(hydroxymethyl)cyclopentyl]quinoline-2-carboxamide
CID 103856999
4-amino-N-(2-cyclopropyl-2-hydroxyethyl)quinoline-2-carboxamide
CID 115485639
4-aminoquinoline-2-carboxylic acid;hydrochloride
CID 171379335
4-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]quinoline-2-carboxamide
CID 63375694
4-amino-N-(2-iodophenyl)quinoline-2-carboxamide
CID 63375620
4-amino-N-(1,3,4-thiadiazol-2-yl)quinoline-2-carboxamide
CID 63377505
4-amino-N-(1-methyl-2-oxopyrrolidin-3-yl)quinoline-2-carboxamide
CID 103827378
4-amino-N-[2-(cyclopenten-1-yl)ethyl]quinoline-2-carboxamide
CID 103843001

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-cyclopentyloxyquinoline-2-carboxamide?
The IUPAC name of 4-amino-N-cyclopentyloxyquinoline-2-carboxamide (CID 83216868) is 4-amino-N-cyclopentyloxyquinoline-2-carboxamide.
What is the SMILES notation for 4-amino-N-cyclopentyloxyquinoline-2-carboxamide?
The canonical SMILES for 4-amino-N-cyclopentyloxyquinoline-2-carboxamide is Nc1cc(C(=O)NOC2CCCC2)nc2ccccc12.
What is the InChIKey of 4-amino-N-cyclopentyloxyquinoline-2-carboxamide?
The InChIKey is PKJOOBYKRYNSFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O2/c16-12-9-14(17-13-8-4-3-7-11(12)13)15(19)18-20-10-5-1-2-6-10/h3-4,7-10H,1-2,5-6H2,(H2,16,17)(H,18,19).
What are the key properties of 4-amino-N-cyclopentyloxyquinoline-2-carboxamide?
4-amino-N-cyclopentyloxyquinoline-2-carboxamide has a molecular weight of 271.32 g/mol, XLogP of 2.42, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-cyclopentyloxyquinoline-2-carboxamide is sourced from PubChem (CID 83216868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).