2-amino-3-(4-hydroxyphenyl)-N-(2-piperidin-1-ylethyl)propanamide

C16H25N3O2 — CID 76905886

IUPAC2-amino-3-(4-hydroxyphenyl)-N-(2-piperidin-1-ylethyl)propanamide
SMILESNC(Cc1ccc(O)cc1)C(=O)NCCN1CCCCC1
InChIInChI=1S/C16H25N3O2/c17-15(12-13-4-6-14(20)7-5-13)16(21)18-8-11-19-9-2-1-3-10-19/h4-7,15,20H,1-3,8-12,17H2,(H,18,21)
InChIKeyIIIXQYZMIWGSFY-UHFFFAOYSA-N
MW291.39 g/mol
LogP0.86
Rot. Bonds6

About 2-amino-3-(4-hydroxyphenyl)-N-(2-piperidin-1-ylethyl)propanamide

2-amino-3-(4-hydroxyphenyl)-N-(2-piperidin-1-ylethyl)propanamide (PubChem CID 76905886) has the molecular formula C16H25N3O2 and a molecular weight of 291.39 g/mol. Its IUPAC name is 2-amino-3-(4-hydroxyphenyl)-N-(2-piperidin-1-ylethyl)propanamide.

Molecular Properties

Compound Name2-amino-3-(4-hydroxyphenyl)-N-(2-piperidin-1-ylethyl)propanamide
PubChem CID76905886
Molecular FormulaC16H25N3O2
Molecular Weight291.39 g/mol
Exact Mass291.19
IUPAC Name2-amino-3-(4-hydroxyphenyl)-N-(2-piperidin-1-ylethyl)propanamide
SMILESNC(Cc1ccc(O)cc1)C(=O)NCCN1CCCCC1
InChIInChI=1S/C16H25N3O2/c17-15(12-13-4-6-14(20)7-5-13)16(21)18-8-11-19-9-2-1-3-10-19/h4-7,15,20H,1-3,8-12,17H2,(H,18,21)
InChIKeyIIIXQYZMIWGSFY-UHFFFAOYSA-N
XLogP0.86
TPSA78.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.39
LogP ≤ 50.86
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 2-amino-3-(4-hydroxyphenyl)-N-(2-piperidin-1-ylethyl)propanamide 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

2-amino-3-(4-hydroxyphenyl)-N-(2-pyrrolidin-1-ylethyl)propanamide
CID 76893887
(2S)-3-(4-hydroxyphenyl)-2-phenyl-N-(2-piperidin-1-ylethyl)propanamide
CID 97445107
(2R)-2-amino-3-(4-hydroxyphenyl)-N-(2-pyrrol-1-ylethyl)propanamide
CID 106391024
(2S)-2-amino-3-(4-hydroxyphenyl)-N-piperidin-1-ylpropanamide
CID 83021846
(2S)-2-amino-N-(2-hydroxyethyl)-3-(4-hydroxyphenyl)propanamide
CID 61155006
(2R)-2-amino-3-(4-hydroxyphenyl)-N-methyl-N-(2-pyrrolidin-1-ylethyl)propanamide
CID 104905132
(2S)-2-amino-3-(4-hydroxyphenyl)-N-[(1-piperidin-1-ylcyclopentyl)methyl]propanamide
CID 131929889
(2S)-2-amino-N-(3-amino-3-oxopropyl)-3-(4-hydroxyphenyl)propanamide
CID 61156108
(2R)-2-amino-N-(3-amino-3-oxopropyl)-3-(4-hydroxyphenyl)propanamide
CID 104904759
(2R)-2-amino-N-[2-(4-methylpiperidin-1-yl)ethyl]-3-phenylpropanamide
CID 78984703
(2R)-2-amino-N-[2-(cyclopenten-1-yl)ethyl]-3-(4-hydroxyphenyl)propanamide
CID 106175266
tritert-butyl 10-[3-[[2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propyl]-1,4,7,10-tetrazacyclododecane-1,4,7-tricarboxylate
CID 68612774

Frequently Asked Questions

What is the IUPAC name of 2-amino-3-(4-hydroxyphenyl)-N-(2-piperidin-1-ylethyl)propanamide?
The IUPAC name of 2-amino-3-(4-hydroxyphenyl)-N-(2-piperidin-1-ylethyl)propanamide (CID 76905886) is 2-amino-3-(4-hydroxyphenyl)-N-(2-piperidin-1-ylethyl)propanamide.
What is the SMILES notation for 2-amino-3-(4-hydroxyphenyl)-N-(2-piperidin-1-ylethyl)propanamide?
The canonical SMILES for 2-amino-3-(4-hydroxyphenyl)-N-(2-piperidin-1-ylethyl)propanamide is NC(Cc1ccc(O)cc1)C(=O)NCCN1CCCCC1.
What is the InChIKey of 2-amino-3-(4-hydroxyphenyl)-N-(2-piperidin-1-ylethyl)propanamide?
The InChIKey is IIIXQYZMIWGSFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O2/c17-15(12-13-4-6-14(20)7-5-13)16(21)18-8-11-19-9-2-1-3-10-19/h4-7,15,20H,1-3,8-12,17H2,(H,18,21).
What are the key properties of 2-amino-3-(4-hydroxyphenyl)-N-(2-piperidin-1-ylethyl)propanamide?
2-amino-3-(4-hydroxyphenyl)-N-(2-piperidin-1-ylethyl)propanamide has a molecular weight of 291.39 g/mol, XLogP of 0.86, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-(4-hydroxyphenyl)-N-(2-piperidin-1-ylethyl)propanamide is sourced from PubChem (CID 76905886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).