2-(4-chloro-2,5-dimethoxyanilino)-N-phenyl-N-propan-2-ylacetamide

C19H23ClN2O3 — CID 30573201

IUPAC2-(4-chloro-2,5-dimethoxyanilino)-N-phenyl-N-propan-2-ylacetamide
SMILESCOc1cc(NCC(=O)N(c2ccccc2)C(C)C)c(OC)cc1Cl
InChIInChI=1S/C19H23ClN2O3/c1-13(2)22(14-8-6-5-7-9-14)19(23)12-21-16-11-17(24-3)15(20)10-18(16)25-4/h5-11,13,21H,12H2,1-4H3
InChIKeyJPDGSBQCTPOVQS-UHFFFAOYSA-N
MW362.86 g/mol
LogP4.21
Rot. Bonds7

About 2-(4-chloro-2,5-dimethoxyanilino)-N-phenyl-N-propan-2-ylacetamide

2-(4-chloro-2,5-dimethoxyanilino)-N-phenyl-N-propan-2-ylacetamide (PubChem CID 30573201) has the molecular formula C19H23ClN2O3 and a molecular weight of 362.86 g/mol. Its IUPAC name is 2-(4-chloro-2,5-dimethoxyanilino)-N-phenyl-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-(4-chloro-2,5-dimethoxyanilino)-N-phenyl-N-propan-2-ylacetamide
PubChem CID30573201
Molecular FormulaC19H23ClN2O3
Molecular Weight362.86 g/mol
Exact Mass362.14
IUPAC Name2-(4-chloro-2,5-dimethoxyanilino)-N-phenyl-N-propan-2-ylacetamide
SMILESCOc1cc(NCC(=O)N(c2ccccc2)C(C)C)c(OC)cc1Cl
InChIInChI=1S/C19H23ClN2O3/c1-13(2)22(14-8-6-5-7-9-14)19(23)12-21-16-11-17(24-3)15(20)10-18(16)25-4/h5-11,13,21H,12H2,1-4H3
InChIKeyJPDGSBQCTPOVQS-UHFFFAOYSA-N
XLogP4.21
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.86
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(4-chloro-2,5-dimethoxyanilino)-N-phenyl-N-propan-2-ylacetamide 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-(4-chloro-2,5-dimethoxyanilino)-N-methyl-N-phenylacetamide
CID 31054798
2-(2,5-dichloroanilino)-N-phenyl-N-propan-2-ylacetamide
CID 2408074
2-(4-chloro-2,5-dimethoxyanilino)-N-[(1R)-1-phenylethyl]acetamide
CID 9106880
2-(4-chloro-2,5-dimethoxyanilino)-N-(2-ethylphenyl)acetamide
CID 109007659
2-[benzyl(propan-2-yl)amino]-N-(4-chloro-2,5-dimethoxyphenyl)acetamide
CID 24582098
(3S)-N-(4-chloro-2,5-dimethoxyphenyl)-3-phenylbutanamide
CID 2286946
2-(4-chloro-2,5-dimethoxyanilino)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone
CID 47005253
N-carbamoyl-2-(4-chloro-2,5-dimethoxyanilino)acetamide
CID 28572784
3-(4-chloro-2,5-dimethoxyanilino)-2-methylpropanamide
CID 43312033
2-(4-chloro-2-methoxy-5-methylanilino)-N-[(3R)-1,1-dioxothiolan-3-yl]-N-phenylacetamide
CID 39975418
2-(4-chloro-2,5-dimethoxyanilino)-N-(2,6-difluorophenyl)acetamide
CID 31054802
2-(4-chloro-2,5-dimethoxyanilino)-1-(2,5-dimethyl-1-phenylpyrrol-3-yl)ethanone
CID 110654822

Frequently Asked Questions

What is the IUPAC name of 2-(4-chloro-2,5-dimethoxyanilino)-N-phenyl-N-propan-2-ylacetamide?
The IUPAC name of 2-(4-chloro-2,5-dimethoxyanilino)-N-phenyl-N-propan-2-ylacetamide (CID 30573201) is 2-(4-chloro-2,5-dimethoxyanilino)-N-phenyl-N-propan-2-ylacetamide.
What is the SMILES notation for 2-(4-chloro-2,5-dimethoxyanilino)-N-phenyl-N-propan-2-ylacetamide?
The canonical SMILES for 2-(4-chloro-2,5-dimethoxyanilino)-N-phenyl-N-propan-2-ylacetamide is COc1cc(NCC(=O)N(c2ccccc2)C(C)C)c(OC)cc1Cl.
What is the InChIKey of 2-(4-chloro-2,5-dimethoxyanilino)-N-phenyl-N-propan-2-ylacetamide?
The InChIKey is JPDGSBQCTPOVQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23ClN2O3/c1-13(2)22(14-8-6-5-7-9-14)19(23)12-21-16-11-17(24-3)15(20)10-18(16)25-4/h5-11,13,21H,12H2,1-4H3.
What are the key properties of 2-(4-chloro-2,5-dimethoxyanilino)-N-phenyl-N-propan-2-ylacetamide?
2-(4-chloro-2,5-dimethoxyanilino)-N-phenyl-N-propan-2-ylacetamide has a molecular weight of 362.86 g/mol, XLogP of 4.21, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chloro-2,5-dimethoxyanilino)-N-phenyl-N-propan-2-ylacetamide is sourced from PubChem (CID 30573201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).