N-[(1S)-1,3-diphenylpropyl]propanamide

C18H21NO — CID 138984444

IUPACN-[(1S)-1,3-diphenylpropyl]propanamide
SMILESCCC(=O)N[C@@H](CCc1ccccc1)c1ccccc1
InChIInChI=1S/C18H21NO/c1-2-18(20)19-17(16-11-7-4-8-12-16)14-13-15-9-5-3-6-10-15/h3-12,17H,2,13-14H2,1H3,(H,19,20)/t17-/m0/s1
InChIKeyDRBHOVOKMWZVRP-KRWDZBQOSA-N
MW267.37 g/mol
LogP3.89
Rot. Bonds6

About N-[(1S)-1,3-diphenylpropyl]propanamide

N-[(1S)-1,3-diphenylpropyl]propanamide (PubChem CID 138984444) has the molecular formula C18H21NO and a molecular weight of 267.37 g/mol. Its IUPAC name is N-[(1S)-1,3-diphenylpropyl]propanamide.

Molecular Properties

Compound NameN-[(1S)-1,3-diphenylpropyl]propanamide
PubChem CID138984444
Molecular FormulaC18H21NO
Molecular Weight267.37 g/mol
Exact Mass267.16
IUPAC NameN-[(1S)-1,3-diphenylpropyl]propanamide
SMILESCCC(=O)N[C@@H](CCc1ccccc1)c1ccccc1
InChIInChI=1S/C18H21NO/c1-2-18(20)19-17(16-11-7-4-8-12-16)14-13-15-9-5-3-6-10-15/h3-12,17H,2,13-14H2,1H3,(H,19,20)/t17-/m0/s1
InChIKeyDRBHOVOKMWZVRP-KRWDZBQOSA-N
XLogP3.89
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(1,3-diphenylpropyl)-2-(2-methoxyethylamino)acetamide
CID 119737630
N-(1,3-diphenylpropyl)-2-methyl-3-(methylamino)propanamide
CID 119737624
N-(1,3-diphenylpropyl)-2-thiophen-3-ylacetamide
CID 112837699
N-(1,3-diphenylpropyl)-2-methylcyclopropane-1-carboxamide
CID 56796182
4-(1,3-diphenylpropylcarbamoyl)cyclohexane-1-carboxylic acid
CID 120674093
2-(cyclopropylmethoxy)-N-[(1R)-1,3-diphenylpropyl]acetamide
CID 95573632
4-(1,3-diphenylpropylamino)-3-(hydroxymethyl)-4-oxobutanoic acid
CID 167797466
N-(1,4-diphenylbutyl)-3-ethoxypropanamide
CID 56502280
2-(1,3-diphenylpropylamino)propanamide
CID 70078545
3-amino-N-(1,5-diphenylpentyl)propanamide;hydrochloride
CID 119341740
2-(2,4-dioxopyrimidin-1-yl)-N-[(1R)-1,3-diphenylpropyl]acetamide
CID 52511313
N'-[(1S)-1,3-diphenylpropyl]-N-(5-propan-2-yl-1,2-oxazol-3-yl)oxamide
CID 97018830

Frequently Asked Questions

What is the IUPAC name of N-[(1S)-1,3-diphenylpropyl]propanamide?
The IUPAC name of N-[(1S)-1,3-diphenylpropyl]propanamide (CID 138984444) is N-[(1S)-1,3-diphenylpropyl]propanamide.
What is the SMILES notation for N-[(1S)-1,3-diphenylpropyl]propanamide?
The canonical SMILES for N-[(1S)-1,3-diphenylpropyl]propanamide is CCC(=O)N[C@@H](CCc1ccccc1)c1ccccc1.
What is the InChIKey of N-[(1S)-1,3-diphenylpropyl]propanamide?
The InChIKey is DRBHOVOKMWZVRP-KRWDZBQOSA-N. The full InChI is InChI=1S/C18H21NO/c1-2-18(20)19-17(16-11-7-4-8-12-16)14-13-15-9-5-3-6-10-15/h3-12,17H,2,13-14H2,1H3,(H,19,20)/t17-/m0/s1.
What are the key properties of N-[(1S)-1,3-diphenylpropyl]propanamide?
N-[(1S)-1,3-diphenylpropyl]propanamide has a molecular weight of 267.37 g/mol, XLogP of 3.89, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S)-1,3-diphenylpropyl]propanamide is sourced from PubChem (CID 138984444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).