N-(3-hydroxy-2-methylpropyl)-4-(2-methylpropoxy)benzamide

C15H23NO3 — CID 65032098

IUPACN-(3-hydroxy-2-methylpropyl)-4-(2-methylpropoxy)benzamide
SMILESCC(C)COc1ccc(C(=O)NCC(C)CO)cc1
InChIInChI=1S/C15H23NO3/c1-11(2)10-19-14-6-4-13(5-7-14)15(18)16-8-12(3)9-17/h4-7,11-12,17H,8-10H2,1-3H3,(H,16,18)
InChIKeyPICLSJHYGBBWPW-UHFFFAOYSA-N
MW265.35 g/mol
LogP2.08
Rot. Bonds7

About N-(3-hydroxy-2-methylpropyl)-4-(2-methylpropoxy)benzamide

N-(3-hydroxy-2-methylpropyl)-4-(2-methylpropoxy)benzamide (PubChem CID 65032098) has the molecular formula C15H23NO3 and a molecular weight of 265.35 g/mol. Its IUPAC name is N-(3-hydroxy-2-methylpropyl)-4-(2-methylpropoxy)benzamide.

Molecular Properties

Compound NameN-(3-hydroxy-2-methylpropyl)-4-(2-methylpropoxy)benzamide
PubChem CID65032098
Molecular FormulaC15H23NO3
Molecular Weight265.35 g/mol
Exact Mass265.17
IUPAC NameN-(3-hydroxy-2-methylpropyl)-4-(2-methylpropoxy)benzamide
SMILESCC(C)COc1ccc(C(=O)NCC(C)CO)cc1
InChIInChI=1S/C15H23NO3/c1-11(2)10-19-14-6-4-13(5-7-14)15(18)16-8-12(3)9-17/h4-7,11-12,17H,8-10H2,1-3H3,(H,16,18)
InChIKeyPICLSJHYGBBWPW-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

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Related Compounds

N-(3-hydroxy-2-methylpropyl)-3-(2-methylpropoxy)benzamide
CID 65037333
4-(2-methylpropoxy)-N-[3-[[4-(2-methylpropoxy)benzoyl]amino]propyl]benzamide
CID 4938333
4-(2-methylpropoxy)-N'-[4-(2-methylpropoxy)benzoyl]benzohydrazide
CID 4937273
4-(2-methylpropoxy)-N-[8-[[4-(2-methylpropoxy)benzoyl]amino]octyl]benzamide
CID 17233376
N-ethyl-4-[[4-(2-methylpropoxy)benzoyl]amino]benzamide
CID 17234354
lithium 3-[[4-(2-methylpropoxy)benzoyl]amino]propanoate
CID 23705726
[4-(2-methylpropoxy)benzoyl]phosphonic acid
CID 170613482
N-(3-hydroxy-2-methylpropyl)pyridine-4-carboxamide
CID 65031932
4-(2-methylpropoxy)-N-[(4-propan-2-yloxyphenyl)methyl]benzamide
CID 43911075
N'-[4-(2-methylpropoxy)benzoyl]-4-propan-2-ylbenzohydrazide
CID 17177578
4-tert-butyl-N'-[4-(2-methylpropoxy)benzoyl]benzohydrazide
CID 4930158
N-[(2S)-butan-2-yl]-4-(2-methylpropoxy)benzamide
CID 41370977

Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxy-2-methylpropyl)-4-(2-methylpropoxy)benzamide?
The IUPAC name of N-(3-hydroxy-2-methylpropyl)-4-(2-methylpropoxy)benzamide (CID 65032098) is N-(3-hydroxy-2-methylpropyl)-4-(2-methylpropoxy)benzamide.
What is the SMILES notation for N-(3-hydroxy-2-methylpropyl)-4-(2-methylpropoxy)benzamide?
The canonical SMILES for N-(3-hydroxy-2-methylpropyl)-4-(2-methylpropoxy)benzamide is CC(C)COc1ccc(C(=O)NCC(C)CO)cc1.
What is the InChIKey of N-(3-hydroxy-2-methylpropyl)-4-(2-methylpropoxy)benzamide?
The InChIKey is PICLSJHYGBBWPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO3/c1-11(2)10-19-14-6-4-13(5-7-14)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)-4-(2-methylpropoxy)benzamide?
N-(3-hydroxy-2-methylpropyl)-4-(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)-4-(2-methylpropoxy)benzamide is sourced from PubChem (CID 65032098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).