N-[1-(3-chlorophenyl)cyclopropyl]-2-methoxybenzamide

C17H16ClNO2 — CID 110443934

IUPACN-[1-(3-chlorophenyl)cyclopropyl]-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)NC1(c2cccc(Cl)c2)CC1
InChIInChI=1S/C17H16ClNO2/c1-21-15-8-3-2-7-14(15)16(20)19-17(9-10-17)12-5-4-6-13(18)11-12/h2-8,11H,9-10H2,1H3,(H,19,20)
InChIKeyDDTXFYXKOWHSHT-UHFFFAOYSA-N
MW301.77 g/mol
LogP3.77
Rot. Bonds4

About N-[1-(3-chlorophenyl)cyclopropyl]-2-methoxybenzamide

N-[1-(3-chlorophenyl)cyclopropyl]-2-methoxybenzamide (PubChem CID 110443934) has the molecular formula C17H16ClNO2 and a molecular weight of 301.77 g/mol. Its IUPAC name is N-[1-(3-chlorophenyl)cyclopropyl]-2-methoxybenzamide.

Molecular Properties

Compound NameN-[1-(3-chlorophenyl)cyclopropyl]-2-methoxybenzamide
PubChem CID110443934
Molecular FormulaC17H16ClNO2
Molecular Weight301.77 g/mol
Exact Mass301.09
IUPAC NameN-[1-(3-chlorophenyl)cyclopropyl]-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)NC1(c2cccc(Cl)c2)CC1
InChIInChI=1S/C17H16ClNO2/c1-21-15-8-3-2-7-14(15)16(20)19-17(9-10-17)12-5-4-6-13(18)11-12/h2-8,11H,9-10H2,1H3,(H,19,20)
InChIKeyDDTXFYXKOWHSHT-UHFFFAOYSA-N
XLogP3.77
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.77
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[1-(3-chlorophenyl)cyclopropyl]-2-methoxybenzamide 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

2,5-dichloro-N-[1-(3-chlorophenyl)cyclopropyl]benzamide
CID 110440796
2-amino-N-[1-(3-chlorophenyl)cyclopropyl]-4-methoxybenzamide
CID 110451706
N-[1-(3-chlorophenyl)cyclopropyl]-4-methylbenzamide
CID 110440424
2,6-dimethoxy-N-(1-phenylcyclopropyl)benzamide
CID 110443986
N-[1-(3-chlorophenyl)cyclopropyl]-4-fluorobenzamide
CID 110441685
[1-(3-chlorophenyl)cyclopropyl]carbamic acid
CID 122529573
N-[1-(3-chlorophenyl)cyclopropyl]pyridine-2-carboxamide
CID 110444338
N-[1-(3-chlorophenyl)cyclopentyl]acetamide
CID 110441196
2,4,5-trimethoxy-N-[1-[3-(trifluoromethyl)phenyl]cyclopropyl]benzamide
CID 166186485
methyl 2-[[1-(3-chlorophenyl)cyclopropyl]amino]acetate
CID 75443074
1-[1-(3-chlorophenyl)cyclopropyl]-3-ethylurea
CID 110490719
2-chloro-N-[1-(3-chlorophenyl)cyclopropyl]-6-fluorobenzamide
CID 110445814

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-chlorophenyl)cyclopropyl]-2-methoxybenzamide?
The IUPAC name of N-[1-(3-chlorophenyl)cyclopropyl]-2-methoxybenzamide (CID 110443934) is N-[1-(3-chlorophenyl)cyclopropyl]-2-methoxybenzamide.
What is the SMILES notation for N-[1-(3-chlorophenyl)cyclopropyl]-2-methoxybenzamide?
The canonical SMILES for N-[1-(3-chlorophenyl)cyclopropyl]-2-methoxybenzamide is COc1ccccc1C(=O)NC1(c2cccc(Cl)c2)CC1.
What is the InChIKey of N-[1-(3-chlorophenyl)cyclopropyl]-2-methoxybenzamide?
The InChIKey is DDTXFYXKOWHSHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16ClNO2/c1-21-15-8-3-2-7-14(15)16(20)19-17(9-10-17)12-5-4-6-13(18)11-12/h2-8,11H,9-10H2,1H3,(H,19,20).
What are the key properties of N-[1-(3-chlorophenyl)cyclopropyl]-2-methoxybenzamide?
N-[1-(3-chlorophenyl)cyclopropyl]-2-methoxybenzamide has a molecular weight of 301.77 g/mol, XLogP of 3.77, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-chlorophenyl)cyclopropyl]-2-methoxybenzamide is sourced from PubChem (CID 110443934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).