2-chloro-N-[3-chloro-4-(cyclopentylmethoxy)phenyl]acetamide

C14H17Cl2NO2 — CID 146657640

IUPAC2-chloro-N-[3-chloro-4-(cyclopentylmethoxy)phenyl]acetamide
SMILESO=C(CCl)Nc1ccc(OCC2CCCC2)c(Cl)c1
InChIInChI=1S/C14H17Cl2NO2/c15-8-14(18)17-11-5-6-13(12(16)7-11)19-9-10-3-1-2-4-10/h5-7,10H,1-4,8-9H2,(H,17,18)
InChIKeyGUWLNDKRRBABNT-UHFFFAOYSA-N
MW302.20 g/mol
LogP4.09
Rot. Bonds5

About 2-chloro-N-[3-chloro-4-(cyclopentylmethoxy)phenyl]acetamide

2-chloro-N-[3-chloro-4-(cyclopentylmethoxy)phenyl]acetamide (PubChem CID 146657640) has the molecular formula C14H17Cl2NO2 and a molecular weight of 302.20 g/mol. Its IUPAC name is 2-chloro-N-[3-chloro-4-(cyclopentylmethoxy)phenyl]acetamide.

Molecular Properties

Compound Name2-chloro-N-[3-chloro-4-(cyclopentylmethoxy)phenyl]acetamide
PubChem CID146657640
Molecular FormulaC14H17Cl2NO2
Molecular Weight302.20 g/mol
Exact Mass301.06
IUPAC Name2-chloro-N-[3-chloro-4-(cyclopentylmethoxy)phenyl]acetamide
SMILESO=C(CCl)Nc1ccc(OCC2CCCC2)c(Cl)c1
InChIInChI=1S/C14H17Cl2NO2/c15-8-14(18)17-11-5-6-13(12(16)7-11)19-9-10-3-1-2-4-10/h5-7,10H,1-4,8-9H2,(H,17,18)
InChIKeyGUWLNDKRRBABNT-UHFFFAOYSA-N
XLogP4.09
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.20
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

Analyze 2-chloro-N-[3-chloro-4-(cyclopentylmethoxy)phenyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-chloro-N-[3-chloro-4-(difluoromethoxy)phenyl]acetamide
CID 4885557
N'-(3-chloro-4-methoxyphenyl)-N-cyclohexylpropanediamide
CID 108942612
N'-(3-chloro-4-methoxyphenyl)-N-cycloheptylpropanediamide
CID 108951592
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(3-chloro-4-ethoxyphenyl)acetamide
CID 119715566
2-amino-N-(3-chloro-4-ethoxyphenyl)cyclohexane-1-carboxamide
CID 64823768
[3-chloro-4-(cyclobutylmethoxy)phenyl]methanol
CID 65459443
2-chloro-N-[3-chloro-4-[(2-chloroacetyl)amino]phenyl]acetamide
CID 4608777
2-[2-chloro-4-[[2-(oxan-2-yl)acetyl]amino]phenoxy]acetic acid
CID 120688629
2-[2-chloro-4-[[2-[(2S)-oxan-2-yl]acetyl]amino]phenoxy]acetic acid
CID 129469734
N'-(3-chloro-4-methylphenyl)-N-cycloheptylpropanediamide
CID 108951589
(2R)-N-(3-chloro-4-ethoxyphenyl)piperidine-2-carboxamide
CID 93359932
3-chloro-4-(cyclobutylmethoxy)aniline
CID 65459362

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[3-chloro-4-(cyclopentylmethoxy)phenyl]acetamide?
The IUPAC name of 2-chloro-N-[3-chloro-4-(cyclopentylmethoxy)phenyl]acetamide (CID 146657640) is 2-chloro-N-[3-chloro-4-(cyclopentylmethoxy)phenyl]acetamide.
What is the SMILES notation for 2-chloro-N-[3-chloro-4-(cyclopentylmethoxy)phenyl]acetamide?
The canonical SMILES for 2-chloro-N-[3-chloro-4-(cyclopentylmethoxy)phenyl]acetamide is O=C(CCl)Nc1ccc(OCC2CCCC2)c(Cl)c1.
What is the InChIKey of 2-chloro-N-[3-chloro-4-(cyclopentylmethoxy)phenyl]acetamide?
The InChIKey is GUWLNDKRRBABNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17Cl2NO2/c15-8-14(18)17-11-5-6-13(12(16)7-11)19-9-10-3-1-2-4-10/h5-7,10H,1-4,8-9H2,(H,17,18).
What are the key properties of 2-chloro-N-[3-chloro-4-(cyclopentylmethoxy)phenyl]acetamide?
2-chloro-N-[3-chloro-4-(cyclopentylmethoxy)phenyl]acetamide has a molecular weight of 302.20 g/mol, XLogP of 4.09, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[3-chloro-4-(cyclopentylmethoxy)phenyl]acetamide is sourced from PubChem (CID 146657640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).