2-amino-3-phenyl-N-(2-piperidin-1-ylpropyl)propanamide

C17H27N3O — CID 61017950

IUPAC2-amino-3-phenyl-N-(2-piperidin-1-ylpropyl)propanamide
SMILESCC(CNC(=O)C(N)Cc1ccccc1)N1CCCCC1
InChIInChI=1S/C17H27N3O/c1-14(20-10-6-3-7-11-20)13-19-17(21)16(18)12-15-8-4-2-5-9-15/h2,4-5,8-9,14,16H,3,6-7,10-13,18H2,1H3,(H,19,21)
InChIKeyBRKXRDYOBANBQM-UHFFFAOYSA-N
MW289.42 g/mol
LogP1.55
Rot. Bonds6

About 2-amino-3-phenyl-N-(2-piperidin-1-ylpropyl)propanamide

2-amino-3-phenyl-N-(2-piperidin-1-ylpropyl)propanamide (PubChem CID 61017950) has the molecular formula C17H27N3O and a molecular weight of 289.42 g/mol. Its IUPAC name is 2-amino-3-phenyl-N-(2-piperidin-1-ylpropyl)propanamide.

Molecular Properties

Compound Name2-amino-3-phenyl-N-(2-piperidin-1-ylpropyl)propanamide
PubChem CID61017950
Molecular FormulaC17H27N3O
Molecular Weight289.42 g/mol
Exact Mass289.22
IUPAC Name2-amino-3-phenyl-N-(2-piperidin-1-ylpropyl)propanamide
SMILESCC(CNC(=O)C(N)Cc1ccccc1)N1CCCCC1
InChIInChI=1S/C17H27N3O/c1-14(20-10-6-3-7-11-20)13-19-17(21)16(18)12-15-8-4-2-5-9-15/h2,4-5,8-9,14,16H,3,6-7,10-13,18H2,1H3,(H,19,21)
InChIKeyBRKXRDYOBANBQM-UHFFFAOYSA-N
XLogP1.55
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.42
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)propyl]-3-phenylpropanamide;dihydrochloride
CID 119856325
2-amino-N-(2-hydroxypropyl)-3-phenylpropanamide
CID 43500101
(2R)-2-amino-N-(2,3-dimethylbutyl)-3-phenylpropanamide
CID 78996657
(2R)-2-amino-N-(2-hydroxy-3-methylbutyl)-3-phenylpropanamide
CID 113492232
2-amino-N-(2-methylbutyl)-3-phenylpropanamide
CID 55108121
3-(4-chlorophenyl)-2-methyl-N-(2-piperidin-1-ylpropyl)propanamide
CID 110301735
2-amino-3-phenyl-N-(1-piperidin-1-ylpropan-2-yl)propanamide
CID 43695355
1-(1-phenylpropan-2-yl)piperidine
CID 11321650
(2S)-2-amino-N-(2-pyrrolidin-1-ylpropyl)pentanamide
CID 107570261
(2S)-2-amino-3-phenyl-N-(1-piperidin-1-ylpropan-2-yl)propanamide;dihydrochloride
CID 119851464
2-amino-N-(2-methyl-3-morpholin-4-ylpropyl)-3-phenylpropanamide;dihydrochloride
CID 119868997
2-amino-3-methyl-N-(2-piperidin-1-ylpropyl)butanamide
CID 54899691

Frequently Asked Questions

What is the IUPAC name of 2-amino-3-phenyl-N-(2-piperidin-1-ylpropyl)propanamide?
The IUPAC name of 2-amino-3-phenyl-N-(2-piperidin-1-ylpropyl)propanamide (CID 61017950) is 2-amino-3-phenyl-N-(2-piperidin-1-ylpropyl)propanamide.
What is the SMILES notation for 2-amino-3-phenyl-N-(2-piperidin-1-ylpropyl)propanamide?
The canonical SMILES for 2-amino-3-phenyl-N-(2-piperidin-1-ylpropyl)propanamide is CC(CNC(=O)C(N)Cc1ccccc1)N1CCCCC1.
What is the InChIKey of 2-amino-3-phenyl-N-(2-piperidin-1-ylpropyl)propanamide?
The InChIKey is BRKXRDYOBANBQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3O/c1-14(20-10-6-3-7-11-20)13-19-17(21)16(18)12-15-8-4-2-5-9-15/h2,4-5,8-9,14,16H,3,6-7,10-13,18H2,1H3,(H,19,21).
What are the key properties of 2-amino-3-phenyl-N-(2-piperidin-1-ylpropyl)propanamide?
2-amino-3-phenyl-N-(2-piperidin-1-ylpropyl)propanamide has a molecular weight of 289.42 g/mol, XLogP of 1.55, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-phenyl-N-(2-piperidin-1-ylpropyl)propanamide is sourced from PubChem (CID 61017950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).