N-(2-chloro-4-methoxyphenyl)-2-hydroxy-2-methylpropanamide

C11H14ClNO3 — CID 115178559

IUPACN-(2-chloro-4-methoxyphenyl)-2-hydroxy-2-methylpropanamide
SMILESCOc1ccc(NC(=O)C(C)(C)O)c(Cl)c1
InChIInChI=1S/C11H14ClNO3/c1-11(2,15)10(14)13-9-5-4-7(16-3)6-8(9)12/h4-6,15H,1-3H3,(H,13,14)
InChIKeyBHICTJBISRUKRJ-UHFFFAOYSA-N
MW243.69 g/mol
LogP2.06
Rot. Bonds3

About N-(2-chloro-4-methoxyphenyl)-2-hydroxy-2-methylpropanamide

N-(2-chloro-4-methoxyphenyl)-2-hydroxy-2-methylpropanamide (PubChem CID 115178559) has the molecular formula C11H14ClNO3 and a molecular weight of 243.69 g/mol. Its IUPAC name is N-(2-chloro-4-methoxyphenyl)-2-hydroxy-2-methylpropanamide.

Molecular Properties

Compound NameN-(2-chloro-4-methoxyphenyl)-2-hydroxy-2-methylpropanamide
PubChem CID115178559
Molecular FormulaC11H14ClNO3
Molecular Weight243.69 g/mol
Exact Mass243.07
IUPAC NameN-(2-chloro-4-methoxyphenyl)-2-hydroxy-2-methylpropanamide
SMILESCOc1ccc(NC(=O)C(C)(C)O)c(Cl)c1
InChIInChI=1S/C11H14ClNO3/c1-11(2,15)10(14)13-9-5-4-7(16-3)6-8(9)12/h4-6,15H,1-3H3,(H,13,14)
InChIKeyBHICTJBISRUKRJ-UHFFFAOYSA-N
XLogP2.06
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.69
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(2-chloro-4-methoxyphenyl)-2-hydroxy-2-methylpropanamide 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-4-methoxyphenyl)carbamothioic S-acid
CID 115169707
N-[4,5-dichloro-2-[(2-hydroxy-2-methylpropanoyl)amino]phenyl]-2-hydroxy-2-methylpropanamide
CID 22287352
N-[2-(2-chloro-4-methoxyanilino)-2-oxoethyl]-3,3-dimethylbutanamide
CID 86860337
3-[(2-chloro-4-methoxyphenyl)carbamoylamino]-2,2-dimethylpropanamide
CID 86862773
tert-butyl N-[2-(2-chloro-4-methoxyanilino)-2-oxoethyl]carbamate
CID 86860346
N-(2-chloro-4-methoxyphenyl)cyclopentanecarboxamide
CID 110777920
1-amino-N-(2-chloro-4-methoxyphenyl)cyclopropane-1-carboxamide
CID 115189617
2-[(2-chloro-4-methoxyphenyl)carbamoylamino]acetic acid
CID 82500241
N-(2,4-dimethoxyphenyl)-2,2-dimethylpropanamide
CID 3713993
1-(2-chloro-4-methoxyphenyl)-3-(1-hydroxy-2-methylpentan-2-yl)urea
CID 111754789
N-(2-chloro-4-hydroxyphenyl)-4-methoxybenzamide;N-(2-chloro-4-methoxyphenyl)-4-methoxybenzamide
CID 86605166
4-amino-N-(2-chloro-5-methoxyphenyl)-2,2-dimethylbutanamide
CID 114285613

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-4-methoxyphenyl)-2-hydroxy-2-methylpropanamide?
The IUPAC name of N-(2-chloro-4-methoxyphenyl)-2-hydroxy-2-methylpropanamide (CID 115178559) is N-(2-chloro-4-methoxyphenyl)-2-hydroxy-2-methylpropanamide.
What is the SMILES notation for N-(2-chloro-4-methoxyphenyl)-2-hydroxy-2-methylpropanamide?
The canonical SMILES for N-(2-chloro-4-methoxyphenyl)-2-hydroxy-2-methylpropanamide is COc1ccc(NC(=O)C(C)(C)O)c(Cl)c1.
What is the InChIKey of N-(2-chloro-4-methoxyphenyl)-2-hydroxy-2-methylpropanamide?
The InChIKey is BHICTJBISRUKRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14ClNO3/c1-11(2,15)10(14)13-9-5-4-7(16-3)6-8(9)12/h4-6,15H,1-3H3,(H,13,14).
What are the key properties of N-(2-chloro-4-methoxyphenyl)-2-hydroxy-2-methylpropanamide?
N-(2-chloro-4-methoxyphenyl)-2-hydroxy-2-methylpropanamide has a molecular weight of 243.69 g/mol, XLogP of 2.06, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-4-methoxyphenyl)-2-hydroxy-2-methylpropanamide is sourced from PubChem (CID 115178559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).