2-(1,3-diphenylpropylamino)propanamide

C18H22N2O — CID 70078545

IUPAC2-(1,3-diphenylpropylamino)propanamide
SMILESCC(NC(CCc1ccccc1)c1ccccc1)C(N)=O
InChIInChI=1S/C18H22N2O/c1-14(18(19)21)20-17(16-10-6-3-7-11-16)13-12-15-8-4-2-5-9-15/h2-11,14,17,20H,12-13H2,1H3,(H2,19,21)
InChIKeySQQDZNNAECMSNQ-UHFFFAOYSA-N
MW282.39 g/mol
LogP2.82
Rot. Bonds7

About 2-(1,3-diphenylpropylamino)propanamide

2-(1,3-diphenylpropylamino)propanamide (PubChem CID 70078545) has the molecular formula C18H22N2O and a molecular weight of 282.39 g/mol. Its IUPAC name is 2-(1,3-diphenylpropylamino)propanamide.

Molecular Properties

Compound Name2-(1,3-diphenylpropylamino)propanamide
PubChem CID70078545
Molecular FormulaC18H22N2O
Molecular Weight282.39 g/mol
Exact Mass282.17
IUPAC Name2-(1,3-diphenylpropylamino)propanamide
SMILESCC(NC(CCc1ccccc1)c1ccccc1)C(N)=O
InChIInChI=1S/C18H22N2O/c1-14(18(19)21)20-17(16-10-6-3-7-11-16)13-12-15-8-4-2-5-9-15/h2-11,14,17,20H,12-13H2,1H3,(H2,19,21)
InChIKeySQQDZNNAECMSNQ-UHFFFAOYSA-N
XLogP2.82
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 52.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(1-phenylbutylamino)propanamide
CID 43401102
N-[(1S)-1,3-diphenylpropyl]propanamide
CID 138984444
4-phenyl-2-(propan-2-ylamino)butanamide
CID 62881281
N-(1,3-diphenylpropyl)-2-methyl-3-(methylamino)propanamide
CID 119737624
(2S)-2-methyl-4-phenylbutanamide;molecular hydrogen
CID 143947472
(2R)-2-[[(1R)-2-methyl-1-phenylpropyl]amino]propanamide
CID 9132466
(2S)-2-[[(1S)-2-methyl-1-phenylpropyl]amino]propanamide
CID 9132458
2-[1-(4-chlorophenyl)butylamino]propanamide
CID 43545331
ethane;(2S)-2-(methylamino)-4-phenylbutanamide
CID 142110580
2-(2-phenylethyl)propanediamide
CID 66660020
3-(1-carboxyethylamino)-2-methyl-5-phenylpentanoic acid
CID 21277688
2-amino-2-phenyl-N-(4-phenylbutan-2-yl)acetamide
CID 61254237

Frequently Asked Questions

What is the IUPAC name of 2-(1,3-diphenylpropylamino)propanamide?
The IUPAC name of 2-(1,3-diphenylpropylamino)propanamide (CID 70078545) is 2-(1,3-diphenylpropylamino)propanamide.
What is the SMILES notation for 2-(1,3-diphenylpropylamino)propanamide?
The canonical SMILES for 2-(1,3-diphenylpropylamino)propanamide is CC(NC(CCc1ccccc1)c1ccccc1)C(N)=O.
What is the InChIKey of 2-(1,3-diphenylpropylamino)propanamide?
The InChIKey is SQQDZNNAECMSNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O/c1-14(18(19)21)20-17(16-10-6-3-7-11-16)13-12-15-8-4-2-5-9-15/h2-11,14,17,20H,12-13H2,1H3,(H2,19,21).
What are the key properties of 2-(1,3-diphenylpropylamino)propanamide?
2-(1,3-diphenylpropylamino)propanamide has a molecular weight of 282.39 g/mol, XLogP of 2.82, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,3-diphenylpropylamino)propanamide is sourced from PubChem (CID 70078545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).