N-cyclopentyl-N-[2-(4-fluorophenyl)ethyl]-2-methylcyclopropane-1-carboxamide

C18H24FNO — CID 78853803

IUPACN-cyclopentyl-N-[2-(4-fluorophenyl)ethyl]-2-methylcyclopropane-1-carboxamide
SMILESCC1CC1C(=O)N(CCc1ccc(F)cc1)C1CCCC1
InChIInChI=1S/C18H24FNO/c1-13-12-17(13)18(21)20(16-4-2-3-5-16)11-10-14-6-8-15(19)9-7-14/h6-9,13,16-17H,2-5,10-12H2,1H3
InChIKeyRPFFZMLUXSATKN-UHFFFAOYSA-N
MW289.39 g/mol
LogP3.80
Rot. Bonds5

About N-cyclopentyl-N-[2-(4-fluorophenyl)ethyl]-2-methylcyclopropane-1-carboxamide

N-cyclopentyl-N-[2-(4-fluorophenyl)ethyl]-2-methylcyclopropane-1-carboxamide (PubChem CID 78853803) has the molecular formula C18H24FNO and a molecular weight of 289.39 g/mol. Its IUPAC name is N-cyclopentyl-N-[2-(4-fluorophenyl)ethyl]-2-methylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-N-[2-(4-fluorophenyl)ethyl]-2-methylcyclopropane-1-carboxamide
PubChem CID78853803
Molecular FormulaC18H24FNO
Molecular Weight289.39 g/mol
Exact Mass289.18
IUPAC NameN-cyclopentyl-N-[2-(4-fluorophenyl)ethyl]-2-methylcyclopropane-1-carboxamide
SMILESCC1CC1C(=O)N(CCc1ccc(F)cc1)C1CCCC1
InChIInChI=1S/C18H24FNO/c1-13-12-17(13)18(21)20(16-4-2-3-5-16)11-10-14-6-8-15(19)9-7-14/h6-9,13,16-17H,2-5,10-12H2,1H3
InChIKeyRPFFZMLUXSATKN-UHFFFAOYSA-N
XLogP3.80
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.39
LogP ≤ 53.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-cyclopentyl-N-[2-(4-fluorophenyl)ethyl]-2-methylbutanamide
CID 78853629
9-amino-N-cyclopropyl-N-[2-(4-fluorophenyl)ethyl]bicyclo[3.3.1]nonane-3-carboxamide;hydrochloride
CID 120992814
N-cyclopentyl-1-(4-fluorobenzoyl)-N-[2-(4-fluorophenyl)ethyl]piperidine-4-carboxamide
CID 78853830
N-cyclopentyl-2-(cyclopropylmethylamino)-N-[2-(4-fluorophenyl)ethyl]acetamide
CID 119821530
N-cyclopentyl-N-[2-(4-fluorophenyl)ethyl]-4-(methylsulfonylmethyl)benzamide
CID 78853833
N-cyclopentyl-N-[2-(4-fluorophenyl)ethyl]-4-methylsulfonylbenzamide
CID 78853832
2-amino-N-cyclopentyl-N-[2-(4-fluorophenyl)ethyl]pentanamide;hydrochloride
CID 119345192
5-bromo-N-cyclopentyl-N-[2-(4-fluorophenyl)ethyl]furan-3-carboxamide
CID 78853656
4-acetyl-N-cyclopentyl-N-[2-(4-fluorophenyl)ethyl]-3,5-dimethyl-1H-pyrrole-2-carboxamide
CID 78853816
N-cyclopentyl-N-[2-(4-fluorophenyl)ethyl]-1-(2-methoxyethyl)-5-oxopyrrolidine-3-carboxamide
CID 112817524
N-cyclopentyl-N-[2-(4-fluorophenyl)ethyl]-1-phenyltriazole-4-carboxamide
CID 78860126
N-cyclopentyl-N-[2-(4-fluorophenyl)ethyl]-4-nitrobenzamide
CID 78853764

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-N-[2-(4-fluorophenyl)ethyl]-2-methylcyclopropane-1-carboxamide?
The IUPAC name of N-cyclopentyl-N-[2-(4-fluorophenyl)ethyl]-2-methylcyclopropane-1-carboxamide (CID 78853803) is N-cyclopentyl-N-[2-(4-fluorophenyl)ethyl]-2-methylcyclopropane-1-carboxamide.
What is the SMILES notation for N-cyclopentyl-N-[2-(4-fluorophenyl)ethyl]-2-methylcyclopropane-1-carboxamide?
The canonical SMILES for N-cyclopentyl-N-[2-(4-fluorophenyl)ethyl]-2-methylcyclopropane-1-carboxamide is CC1CC1C(=O)N(CCc1ccc(F)cc1)C1CCCC1.
What is the InChIKey of N-cyclopentyl-N-[2-(4-fluorophenyl)ethyl]-2-methylcyclopropane-1-carboxamide?
The InChIKey is RPFFZMLUXSATKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24FNO/c1-13-12-17(13)18(21)20(16-4-2-3-5-16)11-10-14-6-8-15(19)9-7-14/h6-9,13,16-17H,2-5,10-12H2,1H3.
What are the key properties of N-cyclopentyl-N-[2-(4-fluorophenyl)ethyl]-2-methylcyclopropane-1-carboxamide?
N-cyclopentyl-N-[2-(4-fluorophenyl)ethyl]-2-methylcyclopropane-1-carboxamide has a molecular weight of 289.39 g/mol, XLogP of 3.80, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-N-[2-(4-fluorophenyl)ethyl]-2-methylcyclopropane-1-carboxamide is sourced from PubChem (CID 78853803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).