2-chloro-N-[[4-(2-methyl-1-phenylpropan-2-yl)oxyphenyl]carbamoyl]benzamide

C24H23ClN2O3 — CID 20524420

IUPAC2-chloro-N-[[4-(2-methyl-1-phenylpropan-2-yl)oxyphenyl]carbamoyl]benzamide
SMILESCC(C)(Cc1ccccc1)Oc1ccc(NC(=O)NC(=O)c2ccccc2Cl)cc1
InChIInChI=1S/C24H23ClN2O3/c1-24(2,16-17-8-4-3-5-9-17)30-19-14-12-18(13-15-19)26-23(29)27-22(28)20-10-6-7-11-21(20)25/h3-15H,16H2,1-2H3,(H2,26,27,28,29)
InChIKeyJWCWYIHLPHYVIJ-UHFFFAOYSA-N
MW422.91 g/mol
LogP5.70
Rot. Bonds6

About 2-chloro-N-[[4-(2-methyl-1-phenylpropan-2-yl)oxyphenyl]carbamoyl]benzamide

2-chloro-N-[[4-(2-methyl-1-phenylpropan-2-yl)oxyphenyl]carbamoyl]benzamide (PubChem CID 20524420) has the molecular formula C24H23ClN2O3 and a molecular weight of 422.91 g/mol. Its IUPAC name is 2-chloro-N-[[4-(2-methyl-1-phenylpropan-2-yl)oxyphenyl]carbamoyl]benzamide.

Molecular Properties

Compound Name2-chloro-N-[[4-(2-methyl-1-phenylpropan-2-yl)oxyphenyl]carbamoyl]benzamide
PubChem CID20524420
Molecular FormulaC24H23ClN2O3
Molecular Weight422.91 g/mol
Exact Mass422.14
IUPAC Name2-chloro-N-[[4-(2-methyl-1-phenylpropan-2-yl)oxyphenyl]carbamoyl]benzamide
SMILESCC(C)(Cc1ccccc1)Oc1ccc(NC(=O)NC(=O)c2ccccc2Cl)cc1
InChIInChI=1S/C24H23ClN2O3/c1-24(2,16-17-8-4-3-5-9-17)30-19-14-12-18(13-15-19)26-23(29)27-22(28)20-10-6-7-11-21(20)25/h3-15H,16H2,1-2H3,(H2,26,27,28,29)
InChIKeyJWCWYIHLPHYVIJ-UHFFFAOYSA-N
XLogP5.70
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500422.91
LogP ≤ 55.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-chloro-N-[[4-(2-methyl-1-phenylpropan-2-yl)oxyphenyl]carbamoyl]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

2-chloro-N-[[4-[(4-fluorophenyl)methoxy]phenyl]carbamoyl]benzamide
CID 20524381
2-chloro-N-[[4-[(4-methylphenyl)methoxy]phenyl]carbamoyl]benzamide
CID 20524462
2-chloro-N-[[4-(2,2-dichloro-1,1-difluoroethoxy)phenyl]carbamoyl]benzamide;3-(3-methylphenyl)propylcarbamic acid
CID 67205234
2-chloro-N-[[3-chloro-4-(phenoxymethyl)phenyl]carbamoyl]benzamide
CID 70576608
2-chloro-N-[[4-[(1-phenylprop-1-enylamino)oxymethyl]phenyl]carbamoyl]benzamide
CID 56616220
2-chloro-N-[(3-chloro-4-phenoxyphenyl)carbamoyl]benzamide
CID 13186092
2-chloro-N-[[3-chloro-4-(4-chlorophenoxy)phenyl]carbamoyl]benzamide
CID 44561285
2-chloro-N-[[4-[1-[4-(trifluoromethyl)phenyl]pentoxy]phenyl]carbamoyl]benzamide
CID 20524440
2-chloro-N-[(3-chloro-4-phenylphenyl)carbamoyl]benzamide
CID 134092649
2-chloro-N-[[4-(trifluoromethoxy)phenyl]carbamoyl]benzamide;diethoxy-[(1-phenyl-1,2,4-triazol-3-yl)oxy]-sulfanylidene-λ5-phosphane
CID 87297594
2-chloro-5-fluoro-N-[[4-(trifluoromethoxy)phenyl]carbamoyl]benzamide
CID 13251606
N-[4-[(2-methylpropan-2-yl)oxy]phenyl]-2-phenylacetamide
CID 21043279

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[[4-(2-methyl-1-phenylpropan-2-yl)oxyphenyl]carbamoyl]benzamide?
The IUPAC name of 2-chloro-N-[[4-(2-methyl-1-phenylpropan-2-yl)oxyphenyl]carbamoyl]benzamide (CID 20524420) is 2-chloro-N-[[4-(2-methyl-1-phenylpropan-2-yl)oxyphenyl]carbamoyl]benzamide.
What is the SMILES notation for 2-chloro-N-[[4-(2-methyl-1-phenylpropan-2-yl)oxyphenyl]carbamoyl]benzamide?
The canonical SMILES for 2-chloro-N-[[4-(2-methyl-1-phenylpropan-2-yl)oxyphenyl]carbamoyl]benzamide is CC(C)(Cc1ccccc1)Oc1ccc(NC(=O)NC(=O)c2ccccc2Cl)cc1.
What is the InChIKey of 2-chloro-N-[[4-(2-methyl-1-phenylpropan-2-yl)oxyphenyl]carbamoyl]benzamide?
The InChIKey is JWCWYIHLPHYVIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23ClN2O3/c1-24(2,16-17-8-4-3-5-9-17)30-19-14-12-18(13-15-19)26-23(29)27-22(28)20-10-6-7-11-21(20)25/h3-15H,16H2,1-2H3,(H2,26,27,28,29).
What are the key properties of 2-chloro-N-[[4-(2-methyl-1-phenylpropan-2-yl)oxyphenyl]carbamoyl]benzamide?
2-chloro-N-[[4-(2-methyl-1-phenylpropan-2-yl)oxyphenyl]carbamoyl]benzamide has a molecular weight of 422.91 g/mol, XLogP of 5.70, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[[4-(2-methyl-1-phenylpropan-2-yl)oxyphenyl]carbamoyl]benzamide is sourced from PubChem (CID 20524420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).