N-(3-amino-3-phenylpropyl)-3-phenylpropanamide

C18H22N2O — CID 80505663

IUPACN-(3-amino-3-phenylpropyl)-3-phenylpropanamide
SMILESNC(CCNC(=O)CCc1ccccc1)c1ccccc1
InChIInChI=1S/C18H22N2O/c19-17(16-9-5-2-6-10-16)13-14-20-18(21)12-11-15-7-3-1-4-8-15/h1-10,17H,11-14,19H2,(H,20,21)
InChIKeyDCZPRVAFVCKEHD-UHFFFAOYSA-N
MW282.39 g/mol
LogP2.83
Rot. Bonds7

About N-(3-amino-3-phenylpropyl)-3-phenylpropanamide

N-(3-amino-3-phenylpropyl)-3-phenylpropanamide (PubChem CID 80505663) has the molecular formula C18H22N2O and a molecular weight of 282.39 g/mol. Its IUPAC name is N-(3-amino-3-phenylpropyl)-3-phenylpropanamide.

Molecular Properties

Compound NameN-(3-amino-3-phenylpropyl)-3-phenylpropanamide
PubChem CID80505663
Molecular FormulaC18H22N2O
Molecular Weight282.39 g/mol
Exact Mass282.17
IUPAC NameN-(3-amino-3-phenylpropyl)-3-phenylpropanamide
SMILESNC(CCNC(=O)CCc1ccccc1)c1ccccc1
InChIInChI=1S/C18H22N2O/c19-17(16-9-5-2-6-10-16)13-14-20-18(21)12-11-15-7-3-1-4-8-15/h1-10,17H,11-14,19H2,(H,20,21)
InChIKeyDCZPRVAFVCKEHD-UHFFFAOYSA-N
XLogP2.83
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 ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-amino-3-phenylpropyl)octanamide
CID 80506646
N-(3-amino-3-phenylpropyl)-2-(3-bromophenyl)acetamide
CID 80506871
4-amino-N-(4-amino-4-oxobutyl)-4-phenylbutanamide
CID 63323993
N-(3-amino-3-phenylpropyl)benzamide
CID 80506685
N-[(2S)-2-hydroxy-2-phenylethyl]-3-phenylpropanamide
CID 93032888
N-(3-amino-3-phenylpropyl)-3-(1,2,4-triazol-1-yl)propanamide
CID 80506321
N-[2-(4-aminophenyl)ethyl]-3-phenylpropanamide
CID 39367183
(2S)-2-amino-N'-(2-phenylethyl)pentanediamide
CID 58987488
4-amino-N-[2-oxo-2-(propylamino)ethyl]-4-phenylbutanamide
CID 63323848
N-[2-(3-phenylpropanoylamino)ethyl]butanamide
CID 108573772
3-amino-N-(3,3-diphenylpropyl)propanamide
CID 61260173
N-(3-hydroxy-3-thiophen-3-ylpropyl)-3-phenylpropanamide
CID 121132071

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-3-phenylpropyl)-3-phenylpropanamide?
The IUPAC name of N-(3-amino-3-phenylpropyl)-3-phenylpropanamide (CID 80505663) is N-(3-amino-3-phenylpropyl)-3-phenylpropanamide.
What is the SMILES notation for N-(3-amino-3-phenylpropyl)-3-phenylpropanamide?
The canonical SMILES for N-(3-amino-3-phenylpropyl)-3-phenylpropanamide is NC(CCNC(=O)CCc1ccccc1)c1ccccc1.
What is the InChIKey of N-(3-amino-3-phenylpropyl)-3-phenylpropanamide?
The InChIKey is DCZPRVAFVCKEHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O/c19-17(16-9-5-2-6-10-16)13-14-20-18(21)12-11-15-7-3-1-4-8-15/h1-10,17H,11-14,19H2,(H,20,21).
What are the key properties of N-(3-amino-3-phenylpropyl)-3-phenylpropanamide?
N-(3-amino-3-phenylpropyl)-3-phenylpropanamide has a molecular weight of 282.39 g/mol, XLogP of 2.83, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-3-phenylpropyl)-3-phenylpropanamide is sourced from PubChem (CID 80505663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).