2-(4-butylphenyl)-N-(3-methylcyclopentyl)acetamide

C18H27NO — CID 114549772

IUPAC2-(4-butylphenyl)-N-(3-methylcyclopentyl)acetamide
SMILESCCCCc1ccc(CC(=O)NC2CCC(C)C2)cc1
InChIInChI=1S/C18H27NO/c1-3-4-5-15-7-9-16(10-8-15)13-18(20)19-17-11-6-14(2)12-17/h7-10,14,17H,3-6,11-13H2,1-2H3,(H,19,20)
InChIKeyVZUAEQUTHGVLGC-UHFFFAOYSA-N
MW273.42 g/mol
LogP3.88
Rot. Bonds6

About 2-(4-butylphenyl)-N-(3-methylcyclopentyl)acetamide

2-(4-butylphenyl)-N-(3-methylcyclopentyl)acetamide (PubChem CID 114549772) has the molecular formula C18H27NO and a molecular weight of 273.42 g/mol. Its IUPAC name is 2-(4-butylphenyl)-N-(3-methylcyclopentyl)acetamide.

Molecular Properties

Compound Name2-(4-butylphenyl)-N-(3-methylcyclopentyl)acetamide
PubChem CID114549772
Molecular FormulaC18H27NO
Molecular Weight273.42 g/mol
Exact Mass273.21
IUPAC Name2-(4-butylphenyl)-N-(3-methylcyclopentyl)acetamide
SMILESCCCCc1ccc(CC(=O)NC2CCC(C)C2)cc1
InChIInChI=1S/C18H27NO/c1-3-4-5-15-7-9-16(10-8-15)13-18(20)19-17-11-6-14(2)12-17/h7-10,14,17H,3-6,11-13H2,1-2H3,(H,19,20)
InChIKeyVZUAEQUTHGVLGC-UHFFFAOYSA-N
XLogP3.88
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.42
LogP ≤ 53.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(3,4-dimethylphenyl)-N-(3-methylcyclopentyl)acetamide
CID 114550146
2-(2,3-dihydro-1H-inden-5-yl)-N-(3-methylcyclopentyl)acetamide
CID 114549929
3-[4-(dimethylamino)phenyl]-N-(3-methylcyclopentyl)propanamide
CID 114549618
N-(3-methylcyclopentyl)dodecanamide
CID 114549665
2-(2-hydroxyphenyl)-N-(3-methylcyclopentyl)acetamide
CID 114546911
N-(4-methylcyclohexyl)-2-(4-sulfanylphenyl)acetamide
CID 107021542
3-(1,3-benzodioxol-5-yl)-N-(3-methylcyclopentyl)propanamide
CID 114549652
2-(4-butylphenyl)-N-(2-chloroprop-2-enyl)acetamide
CID 113238577
2-(2-chlorophenyl)-N-(3-methylcyclopentyl)acetamide
CID 114549493
4-butyl-N-(3-methylcyclohexyl)aniline
CID 43103232
2-(4-ethoxyphenyl)-N-(4-methylcyclohexyl)acetamide
CID 78785999
N-(3-methylcyclopentyl)-2-naphthalen-1-ylacetamide
CID 114549688

Frequently Asked Questions

What is the IUPAC name of 2-(4-butylphenyl)-N-(3-methylcyclopentyl)acetamide?
The IUPAC name of 2-(4-butylphenyl)-N-(3-methylcyclopentyl)acetamide (CID 114549772) is 2-(4-butylphenyl)-N-(3-methylcyclopentyl)acetamide.
What is the SMILES notation for 2-(4-butylphenyl)-N-(3-methylcyclopentyl)acetamide?
The canonical SMILES for 2-(4-butylphenyl)-N-(3-methylcyclopentyl)acetamide is CCCCc1ccc(CC(=O)NC2CCC(C)C2)cc1.
What is the InChIKey of 2-(4-butylphenyl)-N-(3-methylcyclopentyl)acetamide?
The InChIKey is VZUAEQUTHGVLGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27NO/c1-3-4-5-15-7-9-16(10-8-15)13-18(20)19-17-11-6-14(2)12-17/h7-10,14,17H,3-6,11-13H2,1-2H3,(H,19,20).
What are the key properties of 2-(4-butylphenyl)-N-(3-methylcyclopentyl)acetamide?
2-(4-butylphenyl)-N-(3-methylcyclopentyl)acetamide has a molecular weight of 273.42 g/mol, XLogP of 3.88, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-butylphenyl)-N-(3-methylcyclopentyl)acetamide is sourced from PubChem (CID 114549772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).