N-[3-[(2,2-dimethylcyclopentyl)amino]phenyl]acetamide

C15H22N2O — CID 79864740

IUPACN-[3-[(2,2-dimethylcyclopentyl)amino]phenyl]acetamide
SMILESCC(=O)Nc1cccc(NC2CCCC2(C)C)c1
InChIInChI=1S/C15H22N2O/c1-11(18)16-12-6-4-7-13(10-12)17-14-8-5-9-15(14,2)3/h4,6-7,10,14,17H,5,8-9H2,1-3H3,(H,16,18)
InChIKeyWXTAPKWNWMFQDN-UHFFFAOYSA-N
MW246.35 g/mol
LogP3.64
Rot. Bonds3

About N-[3-[(2,2-dimethylcyclopentyl)amino]phenyl]acetamide

N-[3-[(2,2-dimethylcyclopentyl)amino]phenyl]acetamide (PubChem CID 79864740) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is N-[3-[(2,2-dimethylcyclopentyl)amino]phenyl]acetamide.

Molecular Properties

Compound NameN-[3-[(2,2-dimethylcyclopentyl)amino]phenyl]acetamide
PubChem CID79864740
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC NameN-[3-[(2,2-dimethylcyclopentyl)amino]phenyl]acetamide
SMILESCC(=O)Nc1cccc(NC2CCCC2(C)C)c1
InChIInChI=1S/C15H22N2O/c1-11(18)16-12-6-4-7-13(10-12)17-14-8-5-9-15(14,2)3/h4,6-7,10,14,17H,5,8-9H2,1-3H3,(H,16,18)
InChIKeyWXTAPKWNWMFQDN-UHFFFAOYSA-N
XLogP3.64
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 53.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[3-[(4,4-dimethylthian-3-yl)amino]phenyl]acetamide
CID 79951402
[3-[(2,2-dimethylcyclopentyl)amino]phenyl]methanol
CID 79859836
3-chloro-N-(2,2-dimethylcyclopentyl)aniline
CID 79865179
1-(3-acetylphenyl)-3-(2,2-dimethylcyclopentyl)urea
CID 79832263
N-(2,2-dimethylcyclopentyl)-3-methoxyaniline
CID 79864652
N-[3-(cyclopropylamino)phenyl]acetamide
CID 45119286
3-[(2,2-dimethylcyclopentyl)amino]-N-propylbenzamide
CID 79864777
2-amino-5-[(2,2-dimethylcyclopentyl)amino]benzoic acid
CID 79872672
[3-(spiro[4.4]nonan-4-ylamino)phenyl]urea
CID 128516105
2-chloro-5-[(2,2-dimethylcyclopentyl)amino]benzoic acid
CID 79859610
N-[4-[(2,2-dimethylcyclopentyl)amino]phenyl]propanamide
CID 79860812
3-[(2,2-dimethylcyclohexyl)amino]-N-methylbenzenesulfonamide
CID 79828479

Frequently Asked Questions

What is the IUPAC name of N-[3-[(2,2-dimethylcyclopentyl)amino]phenyl]acetamide?
The IUPAC name of N-[3-[(2,2-dimethylcyclopentyl)amino]phenyl]acetamide (CID 79864740) is N-[3-[(2,2-dimethylcyclopentyl)amino]phenyl]acetamide.
What is the SMILES notation for N-[3-[(2,2-dimethylcyclopentyl)amino]phenyl]acetamide?
The canonical SMILES for N-[3-[(2,2-dimethylcyclopentyl)amino]phenyl]acetamide is CC(=O)Nc1cccc(NC2CCCC2(C)C)c1.
What is the InChIKey of N-[3-[(2,2-dimethylcyclopentyl)amino]phenyl]acetamide?
The InChIKey is WXTAPKWNWMFQDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-11(18)16-12-6-4-7-13(10-12)17-14-8-5-9-15(14,2)3/h4,6-7,10,14,17H,5,8-9H2,1-3H3,(H,16,18).
What are the key properties of N-[3-[(2,2-dimethylcyclopentyl)amino]phenyl]acetamide?
N-[3-[(2,2-dimethylcyclopentyl)amino]phenyl]acetamide has a molecular weight of 246.35 g/mol, XLogP of 3.64, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(2,2-dimethylcyclopentyl)amino]phenyl]acetamide is sourced from PubChem (CID 79864740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).