1-(2-fluorophenyl)-N,N-bis(2-methoxyethyl)cyclopentane-1-carboxamide

C18H26FNO3 — CID 110436861

IUPAC1-(2-fluorophenyl)-N,N-bis(2-methoxyethyl)cyclopentane-1-carboxamide
SMILESCOCCN(CCOC)C(=O)C1(c2ccccc2F)CCCC1
InChIInChI=1S/C18H26FNO3/c1-22-13-11-20(12-14-23-2)17(21)18(9-5-6-10-18)15-7-3-4-8-16(15)19/h3-4,7-8H,5-6,9-14H2,1-2H3
InChIKeyPXYOAOWCXVVVPE-UHFFFAOYSA-N
MW323.41 g/mol
LogP2.76
Rot. Bonds8

About 1-(2-fluorophenyl)-N,N-bis(2-methoxyethyl)cyclopentane-1-carboxamide

1-(2-fluorophenyl)-N,N-bis(2-methoxyethyl)cyclopentane-1-carboxamide (PubChem CID 110436861) has the molecular formula C18H26FNO3 and a molecular weight of 323.41 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-N,N-bis(2-methoxyethyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-(2-fluorophenyl)-N,N-bis(2-methoxyethyl)cyclopentane-1-carboxamide
PubChem CID110436861
Molecular FormulaC18H26FNO3
Molecular Weight323.41 g/mol
Exact Mass323.19
IUPAC Name1-(2-fluorophenyl)-N,N-bis(2-methoxyethyl)cyclopentane-1-carboxamide
SMILESCOCCN(CCOC)C(=O)C1(c2ccccc2F)CCCC1
InChIInChI=1S/C18H26FNO3/c1-22-13-11-20(12-14-23-2)17(21)18(9-5-6-10-18)15-7-3-4-8-16(15)19/h3-4,7-8H,5-6,9-14H2,1-2H3
InChIKeyPXYOAOWCXVVVPE-UHFFFAOYSA-N
XLogP2.76
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.41
LogP ≤ 52.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 110438277
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CID 110466100
1-(2-fluorophenyl)-N,N-dimethylcyclopropane-1-carboxamide
CID 110485219
1-[1-(2-fluorophenyl)cyclobutyl]-3-(2-methoxyethyl)urea
CID 110469859
2-fluoro-N-(2-methoxyethyl)-N-(3-methoxypropyl)benzamide
CID 54915998
1-amino-N,N-bis(2-methoxyethyl)cyclohexane-1-carboxamide;hydrochloride
CID 119262683
[2-(4-methoxyphenyl)-2-oxoethyl] 1-(2-fluorophenyl)cyclopentane-1-carboxylate
CID 8661519
2,3-difluoro-N,N-bis(2-methoxyethyl)benzamide
CID 62661170
1-(2-fluorophenyl)-N-(2-hydroxyethyl)cyclopentane-1-carboxamide
CID 110438309
3-[(2-fluorophenyl)methyl]-1,1-bis(2-methoxyethyl)urea
CID 108897546
N-(2-acetamidoethyl)-1-(2-fluorophenyl)cyclopentane-1-carboxamide
CID 110438323
1-(2-fluorophenyl)-N-(2-methoxy-2-phenylethyl)cyclopentane-1-carboxamide
CID 60543655

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-N,N-bis(2-methoxyethyl)cyclopentane-1-carboxamide?
The IUPAC name of 1-(2-fluorophenyl)-N,N-bis(2-methoxyethyl)cyclopentane-1-carboxamide (CID 110436861) is 1-(2-fluorophenyl)-N,N-bis(2-methoxyethyl)cyclopentane-1-carboxamide.
What is the SMILES notation for 1-(2-fluorophenyl)-N,N-bis(2-methoxyethyl)cyclopentane-1-carboxamide?
The canonical SMILES for 1-(2-fluorophenyl)-N,N-bis(2-methoxyethyl)cyclopentane-1-carboxamide is COCCN(CCOC)C(=O)C1(c2ccccc2F)CCCC1.
What is the InChIKey of 1-(2-fluorophenyl)-N,N-bis(2-methoxyethyl)cyclopentane-1-carboxamide?
The InChIKey is PXYOAOWCXVVVPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26FNO3/c1-22-13-11-20(12-14-23-2)17(21)18(9-5-6-10-18)15-7-3-4-8-16(15)19/h3-4,7-8H,5-6,9-14H2,1-2H3.
What are the key properties of 1-(2-fluorophenyl)-N,N-bis(2-methoxyethyl)cyclopentane-1-carboxamide?
1-(2-fluorophenyl)-N,N-bis(2-methoxyethyl)cyclopentane-1-carboxamide has a molecular weight of 323.41 g/mol, XLogP of 2.76, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-N,N-bis(2-methoxyethyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 110436861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).