6-amino-N-(2-hydroxy-4-methoxyphenyl)-4,4-dimethylhexanamide

C15H24N2O3 — CID 102695165

IUPAC6-amino-N-(2-hydroxy-4-methoxyphenyl)-4,4-dimethylhexanamide
SMILESCOc1ccc(NC(=O)CCC(C)(C)CCN)c(O)c1
InChIInChI=1S/C15H24N2O3/c1-15(2,8-9-16)7-6-14(19)17-12-5-4-11(20-3)10-13(12)18/h4-5,10,18H,6-9,16H2,1-3H3,(H,17,19)
InChIKeyKAUOELGLGYLHMT-UHFFFAOYSA-N
MW280.37 g/mol
LogP2.49
Rot. Bonds7

About 6-amino-N-(2-hydroxy-4-methoxyphenyl)-4,4-dimethylhexanamide

6-amino-N-(2-hydroxy-4-methoxyphenyl)-4,4-dimethylhexanamide (PubChem CID 102695165) has the molecular formula C15H24N2O3 and a molecular weight of 280.37 g/mol. Its IUPAC name is 6-amino-N-(2-hydroxy-4-methoxyphenyl)-4,4-dimethylhexanamide.

Molecular Properties

Compound Name6-amino-N-(2-hydroxy-4-methoxyphenyl)-4,4-dimethylhexanamide
PubChem CID102695165
Molecular FormulaC15H24N2O3
Molecular Weight280.37 g/mol
Exact Mass280.18
IUPAC Name6-amino-N-(2-hydroxy-4-methoxyphenyl)-4,4-dimethylhexanamide
SMILESCOc1ccc(NC(=O)CCC(C)(C)CCN)c(O)c1
InChIInChI=1S/C15H24N2O3/c1-15(2,8-9-16)7-6-14(19)17-12-5-4-11(20-3)10-13(12)18/h4-5,10,18H,6-9,16H2,1-3H3,(H,17,19)
InChIKeyKAUOELGLGYLHMT-UHFFFAOYSA-N
XLogP2.49
TPSA84.58 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 52.49
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'catechol', 'substructure': 'N/A'}

Analyze 6-amino-N-(2-hydroxy-4-methoxyphenyl)-4,4-dimethylhexanamide 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

5-amino-N-(2-hydroxy-4-methoxyphenyl)pentanamide
CID 102695132
N-(2-hydroxy-4-methoxyphenyl)-3-(methylamino)propanamide
CID 102695280
5-amino-N-(2-hydroxy-4-methoxyphenyl)-4-methylpentanamide
CID 102695232
N-(2-hydroxy-4-methoxyphenyl)-2-(4-methoxyphenyl)acetamide
CID 154796139
N-(2-hydroxy-4-methoxyphenyl)-2-(2,2,2-trifluoroethylamino)acetamide
CID 102695182
2-amino-N-(2-hydroxy-4-methoxyphenyl)-2-methylpentanamide
CID 102695178
6-amino-N-(2,4-dibromophenyl)-4,4-dimethylhexanamide
CID 65290987
6-amino-1-(4-methoxyphenyl)-4,4-dimethylhexan-1-one
CID 116574854
2-[(6-amino-4,4-dimethylhexanoyl)amino]benzoic acid
CID 65291915
4-[(6-amino-4,4-dimethylhexanoyl)amino]-3-chlorobenzoic acid
CID 65291054
6-amino-N-[(1S)-1-(4-methoxyphenyl)ethyl]-4,4-dimethylhexanamide
CID 81368822
N-(2-amino-4-methoxyphenyl)-3-(3,3-dimethylbutoxy)propanamide
CID 66232216

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-(2-hydroxy-4-methoxyphenyl)-4,4-dimethylhexanamide?
The IUPAC name of 6-amino-N-(2-hydroxy-4-methoxyphenyl)-4,4-dimethylhexanamide (CID 102695165) is 6-amino-N-(2-hydroxy-4-methoxyphenyl)-4,4-dimethylhexanamide.
What is the SMILES notation for 6-amino-N-(2-hydroxy-4-methoxyphenyl)-4,4-dimethylhexanamide?
The canonical SMILES for 6-amino-N-(2-hydroxy-4-methoxyphenyl)-4,4-dimethylhexanamide is COc1ccc(NC(=O)CCC(C)(C)CCN)c(O)c1.
What is the InChIKey of 6-amino-N-(2-hydroxy-4-methoxyphenyl)-4,4-dimethylhexanamide?
The InChIKey is KAUOELGLGYLHMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O3/c1-15(2,8-9-16)7-6-14(19)17-12-5-4-11(20-3)10-13(12)18/h4-5,10,18H,6-9,16H2,1-3H3,(H,17,19).
What are the key properties of 6-amino-N-(2-hydroxy-4-methoxyphenyl)-4,4-dimethylhexanamide?
6-amino-N-(2-hydroxy-4-methoxyphenyl)-4,4-dimethylhexanamide has a molecular weight of 280.37 g/mol, XLogP of 2.49, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-(2-hydroxy-4-methoxyphenyl)-4,4-dimethylhexanamide is sourced from PubChem (CID 102695165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).