2-amino-N-(1-ethylpiperidin-4-yl)-3-phenylpropanamide

C16H25N3O — CID 61039141

IUPAC2-amino-N-(1-ethylpiperidin-4-yl)-3-phenylpropanamide
SMILESCCN1CCC(NC(=O)C(N)Cc2ccccc2)CC1
InChIInChI=1S/C16H25N3O/c1-2-19-10-8-14(9-11-19)18-16(20)15(17)12-13-6-4-3-5-7-13/h3-7,14-15H,2,8-12,17H2,1H3,(H,18,20)
InChIKeyPYAFMLMTUSUXPV-UHFFFAOYSA-N
MW275.40 g/mol
LogP1.16
Rot. Bonds5

About 2-amino-N-(1-ethylpiperidin-4-yl)-3-phenylpropanamide

2-amino-N-(1-ethylpiperidin-4-yl)-3-phenylpropanamide (PubChem CID 61039141) has the molecular formula C16H25N3O and a molecular weight of 275.40 g/mol. Its IUPAC name is 2-amino-N-(1-ethylpiperidin-4-yl)-3-phenylpropanamide.

Molecular Properties

Compound Name2-amino-N-(1-ethylpiperidin-4-yl)-3-phenylpropanamide
PubChem CID61039141
Molecular FormulaC16H25N3O
Molecular Weight275.40 g/mol
Exact Mass275.20
IUPAC Name2-amino-N-(1-ethylpiperidin-4-yl)-3-phenylpropanamide
SMILESCCN1CCC(NC(=O)C(N)Cc2ccccc2)CC1
InChIInChI=1S/C16H25N3O/c1-2-19-10-8-14(9-11-19)18-16(20)15(17)12-13-6-4-3-5-7-13/h3-7,14-15H,2,8-12,17H2,1H3,(H,18,20)
InChIKeyPYAFMLMTUSUXPV-UHFFFAOYSA-N
XLogP1.16
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-amino-N-(1-ethylpiperidin-4-yl)-3-phenylpropanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2S)-2-amino-N-(1-methylpiperidin-4-yl)-3-phenylpropanamide
CID 91079232
(2S)-2-amino-N-(1-ethylpiperidin-3-yl)-3-phenylpropanamide;dihydrochloride
CID 119862385
(2S)-2-amino-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]-3-phenylpropanamide;dihydrochloride
CID 119853476
2-amino-N-[1-(2-methoxyethyl)piperidin-4-yl]-3-phenylpropanamide
CID 119861342
(2R)-2-amino-N-(1-cyclopropylpiperidin-4-yl)-3-phenylpropanamide
CID 78984552
2-amino-N-(1-methylsulfonylpiperidin-4-yl)-3-phenylpropanamide;hydrochloride
CID 119276757
2-amino-N-(1-benzylpyrrolidin-3-yl)-3-phenylpropanamide;dihydrochloride
CID 119831669
2-amino-N-[2-(1-ethylpiperidin-4-yl)ethyl]-3-phenylpropanamide;dihydrochloride
CID 119885023
(2R)-2-amino-N-(1-methylpyrrolidin-3-yl)-3-phenylpropanamide
CID 78985707
2-amino-N-(4-ethylcyclohexyl)-3-phenylpropanamide
CID 61470376
(2S)-2-amino-N-(4-methylcyclohexyl)-3-phenylpropanamide
CID 14837100
2-amino-N-[1-(1-methylpiperidin-4-yl)piperidin-4-yl]-3-phenylpropanamide
CID 119868626

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(1-ethylpiperidin-4-yl)-3-phenylpropanamide?
The IUPAC name of 2-amino-N-(1-ethylpiperidin-4-yl)-3-phenylpropanamide (CID 61039141) is 2-amino-N-(1-ethylpiperidin-4-yl)-3-phenylpropanamide.
What is the SMILES notation for 2-amino-N-(1-ethylpiperidin-4-yl)-3-phenylpropanamide?
The canonical SMILES for 2-amino-N-(1-ethylpiperidin-4-yl)-3-phenylpropanamide is CCN1CCC(NC(=O)C(N)Cc2ccccc2)CC1.
What is the InChIKey of 2-amino-N-(1-ethylpiperidin-4-yl)-3-phenylpropanamide?
The InChIKey is PYAFMLMTUSUXPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O/c1-2-19-10-8-14(9-11-19)18-16(20)15(17)12-13-6-4-3-5-7-13/h3-7,14-15H,2,8-12,17H2,1H3,(H,18,20).
What are the key properties of 2-amino-N-(1-ethylpiperidin-4-yl)-3-phenylpropanamide?
2-amino-N-(1-ethylpiperidin-4-yl)-3-phenylpropanamide has a molecular weight of 275.40 g/mol, XLogP of 1.16, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(1-ethylpiperidin-4-yl)-3-phenylpropanamide is sourced from PubChem (CID 61039141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).