7-amino-N-(4-cyclopentyloxy-3-fluorophenyl)heptanamide

C18H27FN2O2 — CID 119806500

IUPAC7-amino-N-(4-cyclopentyloxy-3-fluorophenyl)heptanamide
SMILESNCCCCCCC(=O)Nc1ccc(OC2CCCC2)c(F)c1
InChIInChI=1S/C18H27FN2O2/c19-16-13-14(21-18(22)9-3-1-2-6-12-20)10-11-17(16)23-15-7-4-5-8-15/h10-11,13,15H,1-9,12,20H2,(H,21,22)
InChIKeyZAIGSIAZCIZQIE-UHFFFAOYSA-N
MW322.42 g/mol
LogP3.99
Rot. Bonds9

About 7-amino-N-(4-cyclopentyloxy-3-fluorophenyl)heptanamide

7-amino-N-(4-cyclopentyloxy-3-fluorophenyl)heptanamide (PubChem CID 119806500) has the molecular formula C18H27FN2O2 and a molecular weight of 322.42 g/mol. Its IUPAC name is 7-amino-N-(4-cyclopentyloxy-3-fluorophenyl)heptanamide.

Molecular Properties

Compound Name7-amino-N-(4-cyclopentyloxy-3-fluorophenyl)heptanamide
PubChem CID119806500
Molecular FormulaC18H27FN2O2
Molecular Weight322.42 g/mol
Exact Mass322.21
IUPAC Name7-amino-N-(4-cyclopentyloxy-3-fluorophenyl)heptanamide
SMILESNCCCCCCC(=O)Nc1ccc(OC2CCCC2)c(F)c1
InChIInChI=1S/C18H27FN2O2/c19-16-13-14(21-18(22)9-3-1-2-6-12-20)10-11-17(16)23-15-7-4-5-8-15/h10-11,13,15H,1-9,12,20H2,(H,21,22)
InChIKeyZAIGSIAZCIZQIE-UHFFFAOYSA-N
XLogP3.99
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.42
LogP ≤ 53.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

7-amino-N-(4-cyclobutyloxy-3-fluorophenyl)heptanamide;hydrochloride
CID 119811101
6-amino-N-(4-cyclopentyloxyphenyl)hexanamide
CID 43706244
(2S)-2-amino-N-(4-cyclopentyloxy-3-fluorophenyl)propanamide
CID 119336628
6-amino-N-(3-fluoro-4-methylphenyl)hexanamide
CID 24704997
3-amino-N-(4-cyclopentyloxy-3-fluorophenyl)-2-methylbutanamide
CID 120501730
dimethyl (E)-2-(4-cyclopentyloxy-3-fluoroanilino)but-2-enedioate
CID 168568895
N-(4-cyclopentyloxy-3-fluorophenyl)pyrrolidine-2-carboxamide
CID 119336640
2-amino-N-(4-cyclobutyloxy-3-fluorophenyl)-2-methylpentanamide
CID 119811156
3-amino-N-(4-cyclobutyloxy-3-fluorophenyl)cyclohexane-1-carboxamide;hydrochloride
CID 119811117
2-amino-N-(4-cyclopentyloxy-3-fluorophenyl)-2-phenylpropanamide
CID 120593524
7-amino-N-[3-fluoro-4-(oxolan-2-ylmethylamino)phenyl]heptanamide
CID 119892317
N-(4-cyclobutyloxy-3-fluorophenyl)-2-thiomorpholin-3-ylacetamide
CID 119940156

Frequently Asked Questions

What is the IUPAC name of 7-amino-N-(4-cyclopentyloxy-3-fluorophenyl)heptanamide?
The IUPAC name of 7-amino-N-(4-cyclopentyloxy-3-fluorophenyl)heptanamide (CID 119806500) is 7-amino-N-(4-cyclopentyloxy-3-fluorophenyl)heptanamide.
What is the SMILES notation for 7-amino-N-(4-cyclopentyloxy-3-fluorophenyl)heptanamide?
The canonical SMILES for 7-amino-N-(4-cyclopentyloxy-3-fluorophenyl)heptanamide is NCCCCCCC(=O)Nc1ccc(OC2CCCC2)c(F)c1.
What is the InChIKey of 7-amino-N-(4-cyclopentyloxy-3-fluorophenyl)heptanamide?
The InChIKey is ZAIGSIAZCIZQIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27FN2O2/c19-16-13-14(21-18(22)9-3-1-2-6-12-20)10-11-17(16)23-15-7-4-5-8-15/h10-11,13,15H,1-9,12,20H2,(H,21,22).
What are the key properties of 7-amino-N-(4-cyclopentyloxy-3-fluorophenyl)heptanamide?
7-amino-N-(4-cyclopentyloxy-3-fluorophenyl)heptanamide has a molecular weight of 322.42 g/mol, XLogP of 3.99, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-amino-N-(4-cyclopentyloxy-3-fluorophenyl)heptanamide is sourced from PubChem (CID 119806500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).