N-(3-hydroxy-2-methylpropyl)-3-(2-methylpropoxy)benzamide

C15H23NO3 — CID 65037333

IUPACN-(3-hydroxy-2-methylpropyl)-3-(2-methylpropoxy)benzamide
SMILESCC(C)COc1cccc(C(=O)NCC(C)CO)c1
InChIInChI=1S/C15H23NO3/c1-11(2)10-19-14-6-4-5-13(7-14)15(18)16-8-12(3)9-17/h4-7,11-12,17H,8-10H2,1-3H3,(H,16,18)
InChIKeyFJNXUHGTRRZIMO-UHFFFAOYSA-N
MW265.35 g/mol
LogP2.08
Rot. Bonds7

About N-(3-hydroxy-2-methylpropyl)-3-(2-methylpropoxy)benzamide

N-(3-hydroxy-2-methylpropyl)-3-(2-methylpropoxy)benzamide (PubChem CID 65037333) has the molecular formula C15H23NO3 and a molecular weight of 265.35 g/mol. Its IUPAC name is N-(3-hydroxy-2-methylpropyl)-3-(2-methylpropoxy)benzamide.

Molecular Properties

Compound NameN-(3-hydroxy-2-methylpropyl)-3-(2-methylpropoxy)benzamide
PubChem CID65037333
Molecular FormulaC15H23NO3
Molecular Weight265.35 g/mol
Exact Mass265.17
IUPAC NameN-(3-hydroxy-2-methylpropyl)-3-(2-methylpropoxy)benzamide
SMILESCC(C)COc1cccc(C(=O)NCC(C)CO)c1
InChIInChI=1S/C15H23NO3/c1-11(2)10-19-14-6-4-5-13(7-14)15(18)16-8-12(3)9-17/h4-7,11-12,17H,8-10H2,1-3H3,(H,16,18)
InChIKeyFJNXUHGTRRZIMO-UHFFFAOYSA-N
XLogP2.08
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.35
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(3-hydroxy-2-methylpropyl)-3-(2-methylpropoxy)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

N-[(2S)-2-hydroxypropyl]-3-(2-methylpropoxy)benzamide
CID 83030958
N-(3-hydroxy-2-methylpropyl)-4-(2-methylpropoxy)benzamide
CID 65032098
2-hydroxy-3-[[3-(2-methylpropoxy)benzoyl]amino]propanoic acid
CID 66168078
N-(4-hydroxybutyl)-3-(2-methylpropoxy)benzamide
CID 106842963
N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-3-(2-methylpropoxy)benzamide
CID 107845536
3-fluoro-N-(3-hydroxy-2-methylpropyl)benzamide
CID 65031989
3-amino-N-(3-hydroxy-2-methylpropyl)benzamide
CID 65032070
N-(2-hydroxypropylcarbamothioyl)-3-(2-methylpropoxy)benzamide
CID 17161995
N-[(3-hydroxycyclobutyl)methyl]-3-(2-methylpropoxy)benzamide
CID 66007075
N-[(4-hydroxypyrrolidin-3-yl)methyl]-3-(2-methylpropoxy)benzamide
CID 120948701
3-(2-methylpropoxy)benzoyl chloride
CID 4772728
trans-(1S,2R)-2-[[[3-(2-methylpropoxy)benzoyl]amino]methyl]cyclohexane-1-carboxylic acid
CID 108732264

Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxy-2-methylpropyl)-3-(2-methylpropoxy)benzamide?
The IUPAC name of N-(3-hydroxy-2-methylpropyl)-3-(2-methylpropoxy)benzamide (CID 65037333) is N-(3-hydroxy-2-methylpropyl)-3-(2-methylpropoxy)benzamide.
What is the SMILES notation for N-(3-hydroxy-2-methylpropyl)-3-(2-methylpropoxy)benzamide?
The canonical SMILES for N-(3-hydroxy-2-methylpropyl)-3-(2-methylpropoxy)benzamide is CC(C)COc1cccc(C(=O)NCC(C)CO)c1.
What is the InChIKey of N-(3-hydroxy-2-methylpropyl)-3-(2-methylpropoxy)benzamide?
The InChIKey is FJNXUHGTRRZIMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO3/c1-11(2)10-19-14-6-4-5-13(7-14)15(18)16-8-12(3)9-17/h4-7,11-12,17H,8-10H2,1-3H3,(H,16,18).
What are the key properties of N-(3-hydroxy-2-methylpropyl)-3-(2-methylpropoxy)benzamide?
N-(3-hydroxy-2-methylpropyl)-3-(2-methylpropoxy)benzamide has a molecular weight of 265.35 g/mol, XLogP of 2.08, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxy-2-methylpropyl)-3-(2-methylpropoxy)benzamide is sourced from PubChem (CID 65037333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).