3-(benzhydrylamino)-2-methylpropanamide

C17H20N2O — CID 43312171

IUPAC3-(benzhydrylamino)-2-methylpropanamide
SMILESCC(CNC(c1ccccc1)c1ccccc1)C(N)=O
InChIInChI=1S/C17H20N2O/c1-13(17(18)20)12-19-16(14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2-11,13,16,19H,12H2,1H3,(H2,18,20)
InChIKeySHENKCMTDXQPSL-UHFFFAOYSA-N
MW268.36 g/mol
LogP2.49
Rot. Bonds6

About 3-(benzhydrylamino)-2-methylpropanamide

3-(benzhydrylamino)-2-methylpropanamide (PubChem CID 43312171) has the molecular formula C17H20N2O and a molecular weight of 268.36 g/mol. Its IUPAC name is 3-(benzhydrylamino)-2-methylpropanamide.

Molecular Properties

Compound Name3-(benzhydrylamino)-2-methylpropanamide
PubChem CID43312171
Molecular FormulaC17H20N2O
Molecular Weight268.36 g/mol
Exact Mass268.16
IUPAC Name3-(benzhydrylamino)-2-methylpropanamide
SMILESCC(CNC(c1ccccc1)c1ccccc1)C(N)=O
InChIInChI=1S/C17H20N2O/c1-13(17(18)20)12-19-16(14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2-11,13,16,19H,12H2,1H3,(H2,18,20)
InChIKeySHENKCMTDXQPSL-UHFFFAOYSA-N
XLogP2.49
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-(benzhydrylamino)-3-methylbutanamide
CID 54455149
3-[[(4-fluorophenyl)-phenylmethyl]amino]-2-hydroxypropanamide
CID 106171119
methyl (2S)-2-[(benzhydrylamino)methyl]butanoate
CID 171614012
N-benzhydryl-2-bromopropan-1-amine
CID 57148463
2-hydroxy-3-[[(2-methylphenyl)-phenylmethyl]amino]propanamide
CID 106171878
(2R)-2-methyl-4-oxo-5,5-diphenylpentanamide
CID 162242633
2-methyl-N-[(1R)-1-phenylethyl]-3-[[(1S)-1-phenylethyl]amino]propanamide
CID 102214409
3-[(2-methoxy-2-oxo-1-phenylethyl)amino]-2-methylpropanoic acid
CID 62110684
(2R)-1-[[phenyl(pyridin-4-yl)methyl]amino]propan-2-ol
CID 113357070
1-[[phenyl(pyridin-4-yl)methyl]amino]propan-2-ol
CID 43608190
2-(1-phenylethylamino)butanamide
CID 62899453
2-(benzhydrylamino)-N-carbamoylpropanamide
CID 42915569

Frequently Asked Questions

What is the IUPAC name of 3-(benzhydrylamino)-2-methylpropanamide?
The IUPAC name of 3-(benzhydrylamino)-2-methylpropanamide (CID 43312171) is 3-(benzhydrylamino)-2-methylpropanamide.
What is the SMILES notation for 3-(benzhydrylamino)-2-methylpropanamide?
The canonical SMILES for 3-(benzhydrylamino)-2-methylpropanamide is CC(CNC(c1ccccc1)c1ccccc1)C(N)=O.
What is the InChIKey of 3-(benzhydrylamino)-2-methylpropanamide?
The InChIKey is SHENKCMTDXQPSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O/c1-13(17(18)20)12-19-16(14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2-11,13,16,19H,12H2,1H3,(H2,18,20).
What are the key properties of 3-(benzhydrylamino)-2-methylpropanamide?
3-(benzhydrylamino)-2-methylpropanamide has a molecular weight of 268.36 g/mol, XLogP of 2.49, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(benzhydrylamino)-2-methylpropanamide is sourced from PubChem (CID 43312171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).