3-amino-2-hydroxy-N-[4-(2-methylpropyl)phenyl]propanamide

C13H20N2O2 — CID 115180236

IUPAC3-amino-2-hydroxy-N-[4-(2-methylpropyl)phenyl]propanamide
SMILESCC(C)Cc1ccc(NC(=O)C(O)CN)cc1
InChIInChI=1S/C13H20N2O2/c1-9(2)7-10-3-5-11(6-4-10)15-13(17)12(16)8-14/h3-6,9,12,16H,7-8,14H2,1-2H3,(H,15,17)
InChIKeyHFKFJLJBKBPQGQ-UHFFFAOYSA-N
MW236.31 g/mol
LogP1.14
Rot. Bonds5

About 3-amino-2-hydroxy-N-[4-(2-methylpropyl)phenyl]propanamide

3-amino-2-hydroxy-N-[4-(2-methylpropyl)phenyl]propanamide (PubChem CID 115180236) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is 3-amino-2-hydroxy-N-[4-(2-methylpropyl)phenyl]propanamide.

Molecular Properties

Compound Name3-amino-2-hydroxy-N-[4-(2-methylpropyl)phenyl]propanamide
PubChem CID115180236
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC Name3-amino-2-hydroxy-N-[4-(2-methylpropyl)phenyl]propanamide
SMILESCC(C)Cc1ccc(NC(=O)C(O)CN)cc1
InChIInChI=1S/C13H20N2O2/c1-9(2)7-10-3-5-11(6-4-10)15-13(17)12(16)8-14/h3-6,9,12,16H,7-8,14H2,1-2H3,(H,15,17)
InChIKeyHFKFJLJBKBPQGQ-UHFFFAOYSA-N
XLogP1.14
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 51.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 3-amino-2-hydroxy-N-[4-(2-methylpropyl)phenyl]propanamide 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,2-bis[4-(2-methylpropyl)phenyl]propanamide
CID 3436173
[4-(2-methylpropyl)phenyl]carbamic acid
CID 115170610
(2R)-3-amino-2-hydroxy-N-phenylpropanamide
CID 91043258
[4-(2-methylpropyl)phenyl]carbamothioic S-acid
CID 115169658
N-[4-(2-methylpropyl)phenyl]carbamoyl chloride
CID 115194334
2-cyano-3-methyl-N-[4-(2-methylpropyl)phenyl]butanamide
CID 115188500
(2R)-2-[4-(2-methylpropyl)phenyl]-N-(4-propan-2-ylphenyl)propanamide
CID 7313989
2-[4-(2-methylpropyl)phenyl]-N-[4-[4-[2-[4-(2-methylpropyl)phenyl]propanoylamino]phenyl]phenyl]propanamide
CID 54781151
1-(aminomethyl)-N-[4-(2-methylpropyl)phenyl]cyclopropane-1-carboxamide
CID 115182510
3-[4-(2-methylpropyl)anilino]-3-oxopropanoic acid
CID 115163213
methyl 2-[4-(2-methylpropyl)anilino]-2-oxoacetate
CID 115142143
(2S)-N-[4-(dimethylamino)phenyl]-2-[4-(2-methylpropyl)phenyl]propanamide
CID 25019148

Frequently Asked Questions

What is the IUPAC name of 3-amino-2-hydroxy-N-[4-(2-methylpropyl)phenyl]propanamide?
The IUPAC name of 3-amino-2-hydroxy-N-[4-(2-methylpropyl)phenyl]propanamide (CID 115180236) is 3-amino-2-hydroxy-N-[4-(2-methylpropyl)phenyl]propanamide.
What is the SMILES notation for 3-amino-2-hydroxy-N-[4-(2-methylpropyl)phenyl]propanamide?
The canonical SMILES for 3-amino-2-hydroxy-N-[4-(2-methylpropyl)phenyl]propanamide is CC(C)Cc1ccc(NC(=O)C(O)CN)cc1.
What is the InChIKey of 3-amino-2-hydroxy-N-[4-(2-methylpropyl)phenyl]propanamide?
The InChIKey is HFKFJLJBKBPQGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-9(2)7-10-3-5-11(6-4-10)15-13(17)12(16)8-14/h3-6,9,12,16H,7-8,14H2,1-2H3,(H,15,17).
What are the key properties of 3-amino-2-hydroxy-N-[4-(2-methylpropyl)phenyl]propanamide?
3-amino-2-hydroxy-N-[4-(2-methylpropyl)phenyl]propanamide has a molecular weight of 236.31 g/mol, XLogP of 1.14, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2-hydroxy-N-[4-(2-methylpropyl)phenyl]propanamide is sourced from PubChem (CID 115180236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).