1-(2-fluorophenyl)-N-(3-methoxypropyl)cyclopentane-1-carboxamide

C16H22FNO2 — CID 110438277

IUPAC1-(2-fluorophenyl)-N-(3-methoxypropyl)cyclopentane-1-carboxamide
SMILESCOCCCNC(=O)C1(c2ccccc2F)CCCC1
InChIInChI=1S/C16H22FNO2/c1-20-12-6-11-18-15(19)16(9-4-5-10-16)13-7-2-3-8-14(13)17/h2-3,7-8H,4-6,9-12H2,1H3,(H,18,19)
InChIKeyLENTZXWWNXNQLG-UHFFFAOYSA-N
MW279.36 g/mol
LogP2.79
Rot. Bonds6

About 1-(2-fluorophenyl)-N-(3-methoxypropyl)cyclopentane-1-carboxamide

1-(2-fluorophenyl)-N-(3-methoxypropyl)cyclopentane-1-carboxamide (PubChem CID 110438277) has the molecular formula C16H22FNO2 and a molecular weight of 279.36 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-N-(3-methoxypropyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-(2-fluorophenyl)-N-(3-methoxypropyl)cyclopentane-1-carboxamide
PubChem CID110438277
Molecular FormulaC16H22FNO2
Molecular Weight279.36 g/mol
Exact Mass279.16
IUPAC Name1-(2-fluorophenyl)-N-(3-methoxypropyl)cyclopentane-1-carboxamide
SMILESCOCCCNC(=O)C1(c2ccccc2F)CCCC1
InChIInChI=1S/C16H22FNO2/c1-20-12-6-11-18-15(19)16(9-4-5-10-16)13-7-2-3-8-14(13)17/h2-3,7-8H,4-6,9-12H2,1H3,(H,18,19)
InChIKeyLENTZXWWNXNQLG-UHFFFAOYSA-N
XLogP2.79
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.36
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-(2-fluorophenyl)-N-(2-hydroxyethyl)cyclopentane-1-carboxamide
CID 110438309
1-(2-fluorophenyl)-N-pentylcyclobutane-1-carboxamide
CID 110437588
N-(2-acetamidoethyl)-1-(2-fluorophenyl)cyclopentane-1-carboxamide
CID 110438323
1-(2-fluorophenyl)-N-(3-formamidopropyl)cyclopentane-1-carboxamide
CID 110436859
N-[3-[[1-(2-fluorophenyl)cyclopropanecarbonyl]amino]propyl]benzamide
CID 56793387
1-(2-fluorophenyl)-N-(5-hydroxypentyl)cyclopropane-1-carboxamide
CID 110485230
1-(2-fluorophenyl)-N-(2-methoxy-2-phenylethyl)cyclopentane-1-carboxamide
CID 60543655
1-(2-fluorophenyl)-N-[4-(4-methylpiperazin-1-yl)butyl]cyclobutane-1-carboxamide
CID 110437610
1-(2-fluorophenyl)-N-[(4-methylphenyl)methyl]cyclopentane-1-carboxamide
CID 110438283
1-(2-fluorophenyl)-N,N-bis(2-methoxyethyl)cyclopentane-1-carboxamide
CID 110436861
1-(2-fluorophenyl)-N-(2-methylsulfonylethyl)cyclopropane-1-carboxamide
CID 110612491
1-(4-fluorophenyl)-N-(2-methoxyethyl)cyclopentane-1-carboxamide
CID 112537817

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-N-(3-methoxypropyl)cyclopentane-1-carboxamide?
The IUPAC name of 1-(2-fluorophenyl)-N-(3-methoxypropyl)cyclopentane-1-carboxamide (CID 110438277) is 1-(2-fluorophenyl)-N-(3-methoxypropyl)cyclopentane-1-carboxamide.
What is the SMILES notation for 1-(2-fluorophenyl)-N-(3-methoxypropyl)cyclopentane-1-carboxamide?
The canonical SMILES for 1-(2-fluorophenyl)-N-(3-methoxypropyl)cyclopentane-1-carboxamide is COCCCNC(=O)C1(c2ccccc2F)CCCC1.
What is the InChIKey of 1-(2-fluorophenyl)-N-(3-methoxypropyl)cyclopentane-1-carboxamide?
The InChIKey is LENTZXWWNXNQLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22FNO2/c1-20-12-6-11-18-15(19)16(9-4-5-10-16)13-7-2-3-8-14(13)17/h2-3,7-8H,4-6,9-12H2,1H3,(H,18,19).
What are the key properties of 1-(2-fluorophenyl)-N-(3-methoxypropyl)cyclopentane-1-carboxamide?
1-(2-fluorophenyl)-N-(3-methoxypropyl)cyclopentane-1-carboxamide has a molecular weight of 279.36 g/mol, XLogP of 2.79, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-N-(3-methoxypropyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 110438277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).