N-(5-chloro-2-methoxyphenyl)-3-phenylpropanamide

C16H16ClNO2 — CID 1040166

IUPACN-(5-chloro-2-methoxyphenyl)-3-phenylpropanamide
SMILESCOc1ccc(Cl)cc1NC(=O)CCc1ccccc1
InChIInChI=1S/C16H16ClNO2/c1-20-15-9-8-13(17)11-14(15)18-16(19)10-7-12-5-3-2-4-6-12/h2-6,8-9,11H,7,10H2,1H3,(H,18,19)
InChIKeyVZVLSFVZBJAHAH-UHFFFAOYSA-N
MW289.76 g/mol
LogP3.92
Rot. Bonds5

About N-(5-chloro-2-methoxyphenyl)-3-phenylpropanamide

N-(5-chloro-2-methoxyphenyl)-3-phenylpropanamide (PubChem CID 1040166) has the molecular formula C16H16ClNO2 and a molecular weight of 289.76 g/mol. Its IUPAC name is N-(5-chloro-2-methoxyphenyl)-3-phenylpropanamide.

Molecular Properties

Compound NameN-(5-chloro-2-methoxyphenyl)-3-phenylpropanamide
PubChem CID1040166
Molecular FormulaC16H16ClNO2
Molecular Weight289.76 g/mol
Exact Mass289.09
IUPAC NameN-(5-chloro-2-methoxyphenyl)-3-phenylpropanamide
SMILESCOc1ccc(Cl)cc1NC(=O)CCc1ccccc1
InChIInChI=1S/C16H16ClNO2/c1-20-15-9-8-13(17)11-14(15)18-16(19)10-7-12-5-3-2-4-6-12/h2-6,8-9,11H,7,10H2,1H3,(H,18,19)
InChIKeyVZVLSFVZBJAHAH-UHFFFAOYSA-N
XLogP3.92
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.76
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(5-chloro-2-methoxyphenyl)-3-phenylpropanamide 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-(5-Chloro-2-methoxyphenyl)-3-oxobutanamide
CID 98791
Benzenepropanamide, N-(2-methoxyphenyl)-beta-oxo-
CID 7079
N-(2-methoxy-5-methylphenyl)-2-phenylcyclopropane-1-carboxamide
CID 2862625
2-Chlorodibenz(b,f)-1,4-oxazepin-11(10H)-one
CID 76619
N-(5-Chloro-2-methoxyphenyl)-2-methylbenzamide
CID 576984
N,N'-bis(5-chloro-2-methoxyphenyl)propanediamide
CID 2386166
2'-Methoxy-2-phenylacetanilide
CID 258229
3'-Chloro-4-methoxybenzanilide
CID 346039
N-(5-chloro-2-methoxyphenyl)-2-methoxy-2-phenylacetamide
CID 2897418
Benzamide, N-(4-amino-5-chloro-2-methoxyphenyl)-
CID 80727
N-(3-Chlorophenyl)-3-(4-methoxyphenyl)propanamide
CID 903519
3-[(3-chlorophenyl)amino]-4-(4-methoxyphenyl)-2,5-dihydro-1H-pyrrole-2,5-dione
CID 6539464

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methoxyphenyl)-3-phenylpropanamide?
The IUPAC name of N-(5-chloro-2-methoxyphenyl)-3-phenylpropanamide (CID 1040166) is N-(5-chloro-2-methoxyphenyl)-3-phenylpropanamide.
What is the SMILES notation for N-(5-chloro-2-methoxyphenyl)-3-phenylpropanamide?
The canonical SMILES for N-(5-chloro-2-methoxyphenyl)-3-phenylpropanamide is COc1ccc(Cl)cc1NC(=O)CCc1ccccc1.
What is the InChIKey of N-(5-chloro-2-methoxyphenyl)-3-phenylpropanamide?
The InChIKey is VZVLSFVZBJAHAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16ClNO2/c1-20-15-9-8-13(17)11-14(15)18-16(19)10-7-12-5-3-2-4-6-12/h2-6,8-9,11H,7,10H2,1H3,(H,18,19).
What are the key properties of N-(5-chloro-2-methoxyphenyl)-3-phenylpropanamide?
N-(5-chloro-2-methoxyphenyl)-3-phenylpropanamide has a molecular weight of 289.76 g/mol, XLogP of 3.92, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-methoxyphenyl)-3-phenylpropanamide is sourced from PubChem (CID 1040166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).