2-amino-N-[4-methyl-3-[(2-piperidin-1-ylacetyl)amino]phenyl]-3-phenylpropanamide

C23H30N4O2 — CID 119865161

IUPAC2-amino-N-[4-methyl-3-[(2-piperidin-1-ylacetyl)amino]phenyl]-3-phenylpropanamide
SMILESCc1ccc(NC(=O)C(N)Cc2ccccc2)cc1NC(=O)CN1CCCCC1
InChIInChI=1S/C23H30N4O2/c1-17-10-11-19(25-23(29)20(24)14-18-8-4-2-5-9-18)15-21(17)26-22(28)16-27-12-6-3-7-13-27/h2,4-5,8-11,15,20H,3,6-7,12-14,16,24H2,1H3,(H,25,29)(H,26,28)
InChIKeyFJOBDMYSIAVOJE-UHFFFAOYSA-N
MW394.52 g/mol
LogP2.93
Rot. Bonds7

About 2-amino-N-[4-methyl-3-[(2-piperidin-1-ylacetyl)amino]phenyl]-3-phenylpropanamide

2-amino-N-[4-methyl-3-[(2-piperidin-1-ylacetyl)amino]phenyl]-3-phenylpropanamide (PubChem CID 119865161) has the molecular formula C23H30N4O2 and a molecular weight of 394.52 g/mol. Its IUPAC name is 2-amino-N-[4-methyl-3-[(2-piperidin-1-ylacetyl)amino]phenyl]-3-phenylpropanamide.

Molecular Properties

Compound Name2-amino-N-[4-methyl-3-[(2-piperidin-1-ylacetyl)amino]phenyl]-3-phenylpropanamide
PubChem CID119865161
Molecular FormulaC23H30N4O2
Molecular Weight394.52 g/mol
Exact Mass394.24
IUPAC Name2-amino-N-[4-methyl-3-[(2-piperidin-1-ylacetyl)amino]phenyl]-3-phenylpropanamide
SMILESCc1ccc(NC(=O)C(N)Cc2ccccc2)cc1NC(=O)CN1CCCCC1
InChIInChI=1S/C23H30N4O2/c1-17-10-11-19(25-23(29)20(24)14-18-8-4-2-5-9-18)15-21(17)26-22(28)16-27-12-6-3-7-13-27/h2,4-5,8-11,15,20H,3,6-7,12-14,16,24H2,1H3,(H,25,29)(H,26,28)
InChIKeyFJOBDMYSIAVOJE-UHFFFAOYSA-N
XLogP2.93
TPSA87.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.52
LogP ≤ 52.93
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 2-amino-N-[4-methyl-3-[(2-piperidin-1-ylacetyl)amino]phenyl]-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

2-amino-N-[4-methyl-3-[(2-piperidin-1-ylacetyl)amino]phenyl]-2-phenylacetamide
CID 119865151
2-amino-N-[4-methyl-3-[(2-piperidin-1-ylacetyl)amino]phenyl]-2-phenylacetamide;dihydrochloride
CID 119865150
(2S)-2-amino-4-methyl-N-[4-methyl-3-[(2-piperidin-1-ylacetyl)amino]phenyl]pentanamide
CID 119865203
2-amino-N-[4-methyl-3-[(2-piperidin-1-ylacetyl)amino]phenyl]acetamide
CID 119865183
N-[2-methyl-5-[[2-(2-oxo-1-pyridinyl)acetyl]amino]phenyl]-2-piperidin-1-ylacetamide
CID 86853160
(2S)-2-amino-N-(3-bromo-4-methylphenyl)-3-phenylpropanamide
CID 22691230
2-amino-N-(3-bromo-4-methylphenyl)-3-phenylpropanamide
CID 63334484
(2R)-2-amino-N-(3-iodo-4-methylphenyl)-3-phenylpropanamide
CID 78985668
2-amino-3-phenyl-N-[4-(2-pyrrolidin-1-ylethyl)phenyl]propanamide
CID 119862104
4-amino-3-methoxy-N-[4-methyl-3-[(2-piperidin-1-ylacetyl)amino]phenyl]butanamide;dihydrochloride
CID 120596003
N-[4-methyl-3-[(2-piperidin-1-ylacetyl)amino]phenyl]-3-pyridin-3-ylpropanamide
CID 86852146
2-(cyclopropylmethylamino)-N-[4-methyl-3-[(2-piperidin-1-ylacetyl)amino]phenyl]acetamide
CID 119865177

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[4-methyl-3-[(2-piperidin-1-ylacetyl)amino]phenyl]-3-phenylpropanamide?
The IUPAC name of 2-amino-N-[4-methyl-3-[(2-piperidin-1-ylacetyl)amino]phenyl]-3-phenylpropanamide (CID 119865161) is 2-amino-N-[4-methyl-3-[(2-piperidin-1-ylacetyl)amino]phenyl]-3-phenylpropanamide.
What is the SMILES notation for 2-amino-N-[4-methyl-3-[(2-piperidin-1-ylacetyl)amino]phenyl]-3-phenylpropanamide?
The canonical SMILES for 2-amino-N-[4-methyl-3-[(2-piperidin-1-ylacetyl)amino]phenyl]-3-phenylpropanamide is Cc1ccc(NC(=O)C(N)Cc2ccccc2)cc1NC(=O)CN1CCCCC1.
What is the InChIKey of 2-amino-N-[4-methyl-3-[(2-piperidin-1-ylacetyl)amino]phenyl]-3-phenylpropanamide?
The InChIKey is FJOBDMYSIAVOJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N4O2/c1-17-10-11-19(25-23(29)20(24)14-18-8-4-2-5-9-18)15-21(17)26-22(28)16-27-12-6-3-7-13-27/h2,4-5,8-11,15,20H,3,6-7,12-14,16,24H2,1H3,(H,25,29)(H,26,28).
What are the key properties of 2-amino-N-[4-methyl-3-[(2-piperidin-1-ylacetyl)amino]phenyl]-3-phenylpropanamide?
2-amino-N-[4-methyl-3-[(2-piperidin-1-ylacetyl)amino]phenyl]-3-phenylpropanamide has a molecular weight of 394.52 g/mol, XLogP of 2.93, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[4-methyl-3-[(2-piperidin-1-ylacetyl)amino]phenyl]-3-phenylpropanamide is sourced from PubChem (CID 119865161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).