N-(1,3-diphenylpropyl)-2-methyl-3-(methylamino)propanamide

C20H26N2O — CID 119737624

IUPACN-(1,3-diphenylpropyl)-2-methyl-3-(methylamino)propanamide
SMILESCNCC(C)C(=O)NC(CCc1ccccc1)c1ccccc1
InChIInChI=1S/C20H26N2O/c1-16(15-21-2)20(23)22-19(18-11-7-4-8-12-18)14-13-17-9-5-3-6-10-17/h3-12,16,19,21H,13-15H2,1-2H3,(H,22,23)
InChIKeyXHDWRNUGCQHPAH-UHFFFAOYSA-N
MW310.44 g/mol
LogP3.33
Rot. Bonds8

About N-(1,3-diphenylpropyl)-2-methyl-3-(methylamino)propanamide

N-(1,3-diphenylpropyl)-2-methyl-3-(methylamino)propanamide (PubChem CID 119737624) has the molecular formula C20H26N2O and a molecular weight of 310.44 g/mol. Its IUPAC name is N-(1,3-diphenylpropyl)-2-methyl-3-(methylamino)propanamide.

Molecular Properties

Compound NameN-(1,3-diphenylpropyl)-2-methyl-3-(methylamino)propanamide
PubChem CID119737624
Molecular FormulaC20H26N2O
Molecular Weight310.44 g/mol
Exact Mass310.20
IUPAC NameN-(1,3-diphenylpropyl)-2-methyl-3-(methylamino)propanamide
SMILESCNCC(C)C(=O)NC(CCc1ccccc1)c1ccccc1
InChIInChI=1S/C20H26N2O/c1-16(15-21-2)20(23)22-19(18-11-7-4-8-12-18)14-13-17-9-5-3-6-10-17/h3-12,16,19,21H,13-15H2,1-2H3,(H,22,23)
InChIKeyXHDWRNUGCQHPAH-UHFFFAOYSA-N
XLogP3.33
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.44
LogP ≤ 53.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-[[2-methyl-3-(methylamino)propanoyl]amino]-4-phenylbutanoic acid
CID 79203169
N-(3,3-dimethyl-1-phenylbutyl)-2-methyl-3-(methylamino)propanamide
CID 79196257
N-[(1S)-1,3-diphenylpropyl]propanamide
CID 138984444
N-(3,3-dimethyl-1-phenylbutyl)-2-methyl-3-(methylamino)propanamide;hydrochloride
CID 119724674
(2R)-N-[(1R)-2-hydroxy-1-phenylethyl]-2-methyl-5-phenylpentanamide
CID 90025591
2-methyl-3-(methylamino)-N-(1-phenylethyl)propanamide;hydrochloride
CID 119669709
(2S)-N-[(1R)-2-(2-chlorophenyl)-1-phenylethyl]-2-methyl-3-(methylamino)propanamide
CID 99815635
4-(1,3-diphenylpropylamino)-3-(hydroxymethyl)-4-oxobutanoic acid
CID 167797466
4-(2-methylbutanoylamino)-4-phenylbutanoic acid
CID 60825193
N-(2-hydroxy-2-phenylethyl)-2-methyl-3-(methylamino)propanamide
CID 79195494
2-(1,3-diphenylpropylamino)propanamide
CID 70078545
N-(1,3-diphenylpropyl)-2-methylcyclopropane-1-carboxamide
CID 56796182

Frequently Asked Questions

What is the IUPAC name of N-(1,3-diphenylpropyl)-2-methyl-3-(methylamino)propanamide?
The IUPAC name of N-(1,3-diphenylpropyl)-2-methyl-3-(methylamino)propanamide (CID 119737624) is N-(1,3-diphenylpropyl)-2-methyl-3-(methylamino)propanamide.
What is the SMILES notation for N-(1,3-diphenylpropyl)-2-methyl-3-(methylamino)propanamide?
The canonical SMILES for N-(1,3-diphenylpropyl)-2-methyl-3-(methylamino)propanamide is CNCC(C)C(=O)NC(CCc1ccccc1)c1ccccc1.
What is the InChIKey of N-(1,3-diphenylpropyl)-2-methyl-3-(methylamino)propanamide?
The InChIKey is XHDWRNUGCQHPAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O/c1-16(15-21-2)20(23)22-19(18-11-7-4-8-12-18)14-13-17-9-5-3-6-10-17/h3-12,16,19,21H,13-15H2,1-2H3,(H,22,23).
What are the key properties of N-(1,3-diphenylpropyl)-2-methyl-3-(methylamino)propanamide?
N-(1,3-diphenylpropyl)-2-methyl-3-(methylamino)propanamide has a molecular weight of 310.44 g/mol, XLogP of 3.33, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3-diphenylpropyl)-2-methyl-3-(methylamino)propanamide is sourced from PubChem (CID 119737624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).