N-cyclopentyl-2-(4-fluorophenyl)-3-methylbutanamide

C16H22FNO — CID 110316813

IUPACN-cyclopentyl-2-(4-fluorophenyl)-3-methylbutanamide
SMILESCC(C)C(C(=O)NC1CCCC1)c1ccc(F)cc1
InChIInChI=1S/C16H22FNO/c1-11(2)15(12-7-9-13(17)10-8-12)16(19)18-14-5-3-4-6-14/h7-11,14-15H,3-6H2,1-2H3,(H,18,19)
InChIKeyQRLSKNPSAJHIJR-UHFFFAOYSA-N
MW263.36 g/mol
LogP3.62
Rot. Bonds4

About N-cyclopentyl-2-(4-fluorophenyl)-3-methylbutanamide

N-cyclopentyl-2-(4-fluorophenyl)-3-methylbutanamide (PubChem CID 110316813) has the molecular formula C16H22FNO and a molecular weight of 263.36 g/mol. Its IUPAC name is N-cyclopentyl-2-(4-fluorophenyl)-3-methylbutanamide.

Molecular Properties

Compound NameN-cyclopentyl-2-(4-fluorophenyl)-3-methylbutanamide
PubChem CID110316813
Molecular FormulaC16H22FNO
Molecular Weight263.36 g/mol
Exact Mass263.17
IUPAC NameN-cyclopentyl-2-(4-fluorophenyl)-3-methylbutanamide
SMILESCC(C)C(C(=O)NC1CCCC1)c1ccc(F)cc1
InChIInChI=1S/C16H22FNO/c1-11(2)15(12-7-9-13(17)10-8-12)16(19)18-14-5-3-4-6-14/h7-11,14-15H,3-6H2,1-2H3,(H,18,19)
InChIKeyQRLSKNPSAJHIJR-UHFFFAOYSA-N
XLogP3.62
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.36
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(4-chlorophenyl)-N-cyclopentyl-3-methylbutanamide
CID 60631278
N-cyclopentyl-2-(4-methoxyphenyl)-3-methylbutanamide
CID 110316904
2-chloro-N-cyclopentyl-2-(4-fluorophenyl)acetamide
CID 62224247
1-cyclopentyl-3-[(1S)-1-(4-fluorophenyl)-2-methylpropyl]urea
CID 41327503
2-(4-chlorophenyl)-N-(4-hydroxycyclohexyl)-3-methylbutanamide
CID 43388740
N-cyclooctyl-2-(4-fluorophenoxy)propanamide
CID 42909316
[(2R)-1-(cyclopentylamino)-1-oxopropan-2-yl] 4-fluorobenzoate
CID 7478290
N-[2-(cyclohexylamino)-2-oxoethyl]-3-(4-fluorophenyl)-4-methylpentanamide
CID 110353932
N-cyclopropyl-2-(4-fluorophenyl)-2-hydroxyacetamide
CID 82126665
2-(4-fluorophenyl)-3-methyl-N-propylbutanamide
CID 110316805
[2-(cyclopentylcarbamoylamino)-2-oxoethyl]-[(1S)-1-(4-fluorophenyl)-2-methylpropyl]azanium
CID 9133689
methyl N-[1-(cyclohexylamino)-3,3-bis(4-fluorophenyl)-1-oxopropan-2-yl]carbamate
CID 138547273

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-(4-fluorophenyl)-3-methylbutanamide?
The IUPAC name of N-cyclopentyl-2-(4-fluorophenyl)-3-methylbutanamide (CID 110316813) is N-cyclopentyl-2-(4-fluorophenyl)-3-methylbutanamide.
What is the SMILES notation for N-cyclopentyl-2-(4-fluorophenyl)-3-methylbutanamide?
The canonical SMILES for N-cyclopentyl-2-(4-fluorophenyl)-3-methylbutanamide is CC(C)C(C(=O)NC1CCCC1)c1ccc(F)cc1.
What is the InChIKey of N-cyclopentyl-2-(4-fluorophenyl)-3-methylbutanamide?
The InChIKey is QRLSKNPSAJHIJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22FNO/c1-11(2)15(12-7-9-13(17)10-8-12)16(19)18-14-5-3-4-6-14/h7-11,14-15H,3-6H2,1-2H3,(H,18,19).
What are the key properties of N-cyclopentyl-2-(4-fluorophenyl)-3-methylbutanamide?
N-cyclopentyl-2-(4-fluorophenyl)-3-methylbutanamide has a molecular weight of 263.36 g/mol, XLogP of 3.62, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-(4-fluorophenyl)-3-methylbutanamide is sourced from PubChem (CID 110316813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).