2-chloro-N-[3-(2-methoxyethoxy)phenyl]benzamide

C16H16ClNO3 — CID 17169773

IUPAC2-chloro-N-[3-(2-methoxyethoxy)phenyl]benzamide
SMILESCOCCOc1cccc(NC(=O)c2ccccc2Cl)c1
InChIInChI=1S/C16H16ClNO3/c1-20-9-10-21-13-6-4-5-12(11-13)18-16(19)14-7-2-3-8-15(14)17/h2-8,11H,9-10H2,1H3,(H,18,19)
InChIKeyHXXCWGNSMIFYTA-UHFFFAOYSA-N
MW305.76 g/mol
LogP3.62
Rot. Bonds6

About 2-chloro-N-[3-(2-methoxyethoxy)phenyl]benzamide

2-chloro-N-[3-(2-methoxyethoxy)phenyl]benzamide (PubChem CID 17169773) has the molecular formula C16H16ClNO3 and a molecular weight of 305.76 g/mol. Its IUPAC name is 2-chloro-N-[3-(2-methoxyethoxy)phenyl]benzamide.

Molecular Properties

Compound Name2-chloro-N-[3-(2-methoxyethoxy)phenyl]benzamide
PubChem CID17169773
Molecular FormulaC16H16ClNO3
Molecular Weight305.76 g/mol
Exact Mass305.08
IUPAC Name2-chloro-N-[3-(2-methoxyethoxy)phenyl]benzamide
SMILESCOCCOc1cccc(NC(=O)c2ccccc2Cl)c1
InChIInChI=1S/C16H16ClNO3/c1-20-9-10-21-13-6-4-5-12(11-13)18-16(19)14-7-2-3-8-15(14)17/h2-8,11H,9-10H2,1H3,(H,18,19)
InChIKeyHXXCWGNSMIFYTA-UHFFFAOYSA-N
XLogP3.62
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.76
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-chloro-N-[3-(2-methoxyethoxy)phenyl]benzamide 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

N-[3-(2-methoxyethoxy)phenyl]-2-(2-phenoxyethoxy)benzamide
CID 17169883
2-chloro-N-[3-(3-phenylpropoxy)phenyl]benzamide
CID 17133169
2-chloro-N-[3-(2-methoxyethoxy)phenyl]pyridine-3-carboxamide
CID 61041501
2-(2-chlorophenoxy)-N-[3-(2-methoxyethoxy)phenyl]acetamide
CID 17169815
2-chloro-N-[3-[2-(ethylamino)-2-oxoethoxy]phenyl]benzamide
CID 39044160
3-(2-chlorophenyl)-N-[3-(2-methoxyethoxy)phenyl]propanamide
CID 17179095
1-(3,4-dichlorophenyl)-3-[3-(2-methoxyethoxy)phenyl]urea
CID 55910965
2,4-dichloro-N-[[3-(2-methoxyethoxy)phenyl]carbamothioyl]benzamide
CID 17169954
2-[2-[[3-(2-methoxyethoxy)phenyl]carbamoyl]phenyl]sulfanylpropanoic acid
CID 120690684
4-chloro-N-[3-(2-methoxyethoxy)phenyl]pyridine-2-carboxamide
CID 61041653
2-fluoro-4-methoxy-N-[3-(2-methoxyethoxy)phenyl]benzamide
CID 87026628
N-[3-(3-methoxypropoxy)phenyl]benzamide
CID 86997539

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[3-(2-methoxyethoxy)phenyl]benzamide?
The IUPAC name of 2-chloro-N-[3-(2-methoxyethoxy)phenyl]benzamide (CID 17169773) is 2-chloro-N-[3-(2-methoxyethoxy)phenyl]benzamide.
What is the SMILES notation for 2-chloro-N-[3-(2-methoxyethoxy)phenyl]benzamide?
The canonical SMILES for 2-chloro-N-[3-(2-methoxyethoxy)phenyl]benzamide is COCCOc1cccc(NC(=O)c2ccccc2Cl)c1.
What is the InChIKey of 2-chloro-N-[3-(2-methoxyethoxy)phenyl]benzamide?
The InChIKey is HXXCWGNSMIFYTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16ClNO3/c1-20-9-10-21-13-6-4-5-12(11-13)18-16(19)14-7-2-3-8-15(14)17/h2-8,11H,9-10H2,1H3,(H,18,19).
What are the key properties of 2-chloro-N-[3-(2-methoxyethoxy)phenyl]benzamide?
2-chloro-N-[3-(2-methoxyethoxy)phenyl]benzamide has a molecular weight of 305.76 g/mol, XLogP of 3.62, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[3-(2-methoxyethoxy)phenyl]benzamide is sourced from PubChem (CID 17169773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).