2-benzamido-N-(4-hydroxybutan-2-yl)benzamide

C18H20N2O3 — CID 3497950

IUPAC2-benzamido-N-(4-hydroxybutan-2-yl)benzamide
SMILESCC(CCO)NC(=O)c1ccccc1NC(=O)c1ccccc1
InChIInChI=1S/C18H20N2O3/c1-13(11-12-21)19-18(23)15-9-5-6-10-16(15)20-17(22)14-7-3-2-4-8-14/h2-10,13,21H,11-12H2,1H3,(H,19,23)(H,20,22)
InChIKeyXDDKWCGBUDJSKV-UHFFFAOYSA-N
MW312.37 g/mol
LogP2.44
Rot. Bonds6

About 2-benzamido-N-(4-hydroxybutan-2-yl)benzamide

2-benzamido-N-(4-hydroxybutan-2-yl)benzamide (PubChem CID 3497950) has the molecular formula C18H20N2O3 and a molecular weight of 312.37 g/mol. Its IUPAC name is 2-benzamido-N-(4-hydroxybutan-2-yl)benzamide.

Molecular Properties

Compound Name2-benzamido-N-(4-hydroxybutan-2-yl)benzamide
PubChem CID3497950
Molecular FormulaC18H20N2O3
Molecular Weight312.37 g/mol
Exact Mass312.15
IUPAC Name2-benzamido-N-(4-hydroxybutan-2-yl)benzamide
SMILESCC(CCO)NC(=O)c1ccccc1NC(=O)c1ccccc1
InChIInChI=1S/C18H20N2O3/c1-13(11-12-21)19-18(23)15-9-5-6-10-16(15)20-17(22)14-7-3-2-4-8-14/h2-10,13,21H,11-12H2,1H3,(H,19,23)(H,20,22)
InChIKeyXDDKWCGBUDJSKV-UHFFFAOYSA-N
XLogP2.44
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 52.44
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-benzamido-N-[(2S)-1-phenylpropan-2-yl]benzamide
CID 51412226
N-[(2R)-butan-2-yl]-2-[(4-methylbenzoyl)amino]benzamide
CID 893770
N-butan-2-yl-2-[(4-methylbenzoyl)amino]benzamide
CID 2942993
N-butan-2-yl-2-[(4-fluorobenzoyl)amino]benzamide
CID 2943228
2-benzamido-N-[2-(2-methylpropanoylamino)ethyl]benzamide
CID 30548525
2-benzamido-N-[1-(2-benzoylhydrazinyl)-3-methyl-1-oxopentan-2-yl]benzamide
CID 3455596
N-[(2R)-butan-2-yl]-2-[(3-fluorobenzoyl)amino]benzamide
CID 26706214
(2R)-2-[(2-benzamidobenzoyl)amino]-3-phenylpropanoic acid
CID 1366278
ethyl (2S)-2-[(2-benzamidobenzoyl)amino]butanoate
CID 2177719
N-[1-(2-benzoylhydrazinyl)-1-oxopropan-2-yl]-2-[(4-methylbenzoyl)amino]benzamide
CID 3829740
N-butan-2-yl-2-[(3-methoxybenzoyl)amino]benzamide
CID 17417921
[2-oxo-2-[[(2S)-pentan-2-yl]amino]ethyl] 2-benzamidobenzoate
CID 2662915

Frequently Asked Questions

What is the IUPAC name of 2-benzamido-N-(4-hydroxybutan-2-yl)benzamide?
The IUPAC name of 2-benzamido-N-(4-hydroxybutan-2-yl)benzamide (CID 3497950) is 2-benzamido-N-(4-hydroxybutan-2-yl)benzamide.
What is the SMILES notation for 2-benzamido-N-(4-hydroxybutan-2-yl)benzamide?
The canonical SMILES for 2-benzamido-N-(4-hydroxybutan-2-yl)benzamide is CC(CCO)NC(=O)c1ccccc1NC(=O)c1ccccc1.
What is the InChIKey of 2-benzamido-N-(4-hydroxybutan-2-yl)benzamide?
The InChIKey is XDDKWCGBUDJSKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O3/c1-13(11-12-21)19-18(23)15-9-5-6-10-16(15)20-17(22)14-7-3-2-4-8-14/h2-10,13,21H,11-12H2,1H3,(H,19,23)(H,20,22).
What are the key properties of 2-benzamido-N-(4-hydroxybutan-2-yl)benzamide?
2-benzamido-N-(4-hydroxybutan-2-yl)benzamide has a molecular weight of 312.37 g/mol, XLogP of 2.44, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzamido-N-(4-hydroxybutan-2-yl)benzamide is sourced from PubChem (CID 3497950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).