3-amino-N-(6-fluoro-2-oxo-3,4-dihydro-1H-quinolin-7-yl)cyclopentane-1-carboxamide

C15H18FN3O2 — CID 66009357

IUPAC3-amino-N-(6-fluoro-2-oxo-3,4-dihydro-1H-quinolin-7-yl)cyclopentane-1-carboxamide
SMILESNC1CCC(C(=O)Nc2cc3c(cc2F)CCC(=O)N3)C1
InChIInChI=1S/C15H18FN3O2/c16-11-6-8-2-4-14(20)18-12(8)7-13(11)19-15(21)9-1-3-10(17)5-9/h6-7,9-10H,1-5,17H2,(H,18,20)(H,19,21)
InChIKeyLZDQQUXLKOUTBC-UHFFFAOYSA-N
MW291.33 g/mol
LogP1.78
Rot. Bonds2

About 3-amino-N-(6-fluoro-2-oxo-3,4-dihydro-1H-quinolin-7-yl)cyclopentane-1-carboxamide

3-amino-N-(6-fluoro-2-oxo-3,4-dihydro-1H-quinolin-7-yl)cyclopentane-1-carboxamide (PubChem CID 66009357) has the molecular formula C15H18FN3O2 and a molecular weight of 291.33 g/mol. Its IUPAC name is 3-amino-N-(6-fluoro-2-oxo-3,4-dihydro-1H-quinolin-7-yl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name3-amino-N-(6-fluoro-2-oxo-3,4-dihydro-1H-quinolin-7-yl)cyclopentane-1-carboxamide
PubChem CID66009357
Molecular FormulaC15H18FN3O2
Molecular Weight291.33 g/mol
Exact Mass291.14
IUPAC Name3-amino-N-(6-fluoro-2-oxo-3,4-dihydro-1H-quinolin-7-yl)cyclopentane-1-carboxamide
SMILESNC1CCC(C(=O)Nc2cc3c(cc2F)CCC(=O)N3)C1
InChIInChI=1S/C15H18FN3O2/c16-11-6-8-2-4-14(20)18-12(8)7-13(11)19-15(21)9-1-3-10(17)5-9/h6-7,9-10H,1-5,17H2,(H,18,20)(H,19,21)
InChIKeyLZDQQUXLKOUTBC-UHFFFAOYSA-N
XLogP1.78
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.33
LogP ≤ 51.78
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(6-fluoro-2-oxo-3,4-dihydro-1H-quinolin-7-yl)cyclopentane-1-carboxamide?
The IUPAC name of 3-amino-N-(6-fluoro-2-oxo-3,4-dihydro-1H-quinolin-7-yl)cyclopentane-1-carboxamide (CID 66009357) is 3-amino-N-(6-fluoro-2-oxo-3,4-dihydro-1H-quinolin-7-yl)cyclopentane-1-carboxamide.
What is the SMILES notation for 3-amino-N-(6-fluoro-2-oxo-3,4-dihydro-1H-quinolin-7-yl)cyclopentane-1-carboxamide?
The canonical SMILES for 3-amino-N-(6-fluoro-2-oxo-3,4-dihydro-1H-quinolin-7-yl)cyclopentane-1-carboxamide is NC1CCC(C(=O)Nc2cc3c(cc2F)CCC(=O)N3)C1.
What is the InChIKey of 3-amino-N-(6-fluoro-2-oxo-3,4-dihydro-1H-quinolin-7-yl)cyclopentane-1-carboxamide?
The InChIKey is LZDQQUXLKOUTBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18FN3O2/c16-11-6-8-2-4-14(20)18-12(8)7-13(11)19-15(21)9-1-3-10(17)5-9/h6-7,9-10H,1-5,17H2,(H,18,20)(H,19,21).
What are the key properties of 3-amino-N-(6-fluoro-2-oxo-3,4-dihydro-1H-quinolin-7-yl)cyclopentane-1-carboxamide?
3-amino-N-(6-fluoro-2-oxo-3,4-dihydro-1H-quinolin-7-yl)cyclopentane-1-carboxamide has a molecular weight of 291.33 g/mol, XLogP of 1.78, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(6-fluoro-2-oxo-3,4-dihydro-1H-quinolin-7-yl)cyclopentane-1-carboxamide is sourced from PubChem (CID 66009357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).