2-amino-N-methyl-2-(4-methylphenyl)-N-(2-oxo-1-phenylpiperidin-3-yl)acetamide

C21H25N3O2 — CID 120668615

IUPAC2-amino-N-methyl-2-(4-methylphenyl)-N-(2-oxo-1-phenylpiperidin-3-yl)acetamide
SMILESCc1ccc(C(N)C(=O)N(C)C2CCCN(c3ccccc3)C2=O)cc1
InChIInChI=1S/C21H25N3O2/c1-15-10-12-16(13-11-15)19(22)21(26)23(2)18-9-6-14-24(20(18)25)17-7-4-3-5-8-17/h3-5,7-8,10-13,18-19H,6,9,14,22H2,1-2H3
InChIKeyRKNYSACQWJCKPX-UHFFFAOYSA-N
MW351.45 g/mol
LogP2.65
Rot. Bonds4

About 2-amino-N-methyl-2-(4-methylphenyl)-N-(2-oxo-1-phenylpiperidin-3-yl)acetamide

2-amino-N-methyl-2-(4-methylphenyl)-N-(2-oxo-1-phenylpiperidin-3-yl)acetamide (PubChem CID 120668615) has the molecular formula C21H25N3O2 and a molecular weight of 351.45 g/mol. Its IUPAC name is 2-amino-N-methyl-2-(4-methylphenyl)-N-(2-oxo-1-phenylpiperidin-3-yl)acetamide.

Molecular Properties

Compound Name2-amino-N-methyl-2-(4-methylphenyl)-N-(2-oxo-1-phenylpiperidin-3-yl)acetamide
PubChem CID120668615
Molecular FormulaC21H25N3O2
Molecular Weight351.45 g/mol
Exact Mass351.19
IUPAC Name2-amino-N-methyl-2-(4-methylphenyl)-N-(2-oxo-1-phenylpiperidin-3-yl)acetamide
SMILESCc1ccc(C(N)C(=O)N(C)C2CCCN(c3ccccc3)C2=O)cc1
InChIInChI=1S/C21H25N3O2/c1-15-10-12-16(13-11-15)19(22)21(26)23(2)18-9-6-14-24(20(18)25)17-7-4-3-5-8-17/h3-5,7-8,10-13,18-19H,6,9,14,22H2,1-2H3
InChIKeyRKNYSACQWJCKPX-UHFFFAOYSA-N
XLogP2.65
TPSA66.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.45
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-methyl-N-(2-oxo-1-phenylpiperidin-3-yl)pentanamide
CID 119328400
4-amino-N-methyl-N-(2-oxo-1-phenylpiperidin-3-yl)butanamide
CID 119328406
1-amino-N-methyl-N-(2-oxo-1-phenylpiperidin-3-yl)cyclopropane-1-carboxamide
CID 119792199
2-amino-N-[1-(2-chlorophenyl)-2-oxopyrrolidin-3-yl]-N-methyl-2-phenylacetamide;hydrochloride
CID 119323471
1-hydroxy-N-methyl-N-(2-oxo-1-phenylpiperidin-3-yl)cyclopentane-1-carboxamide
CID 111389802
2-amino-N-methyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)pentanamide;hydrochloride
CID 119319409
2-amino-N-cyclopentyl-N-methyl-2-(4-methylphenyl)acetamide
CID 106151212
N-methyl-4-(methylamino)-N-(2-oxo-1-phenylpiperidin-3-yl)butanamide
CID 119792209
N-methyl-4-(methylamino)-N-(2-oxo-1-phenylpiperidin-3-yl)butanamide;hydrochloride
CID 119792208
2-amino-N,2-dimethyl-N-(2-oxo-1-phenylpiperidin-3-yl)pentanamide
CID 119792253
3-amino-N-methyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)propanamide
CID 119319400
(2S,5R)-5-(aminomethyl)-N-methyl-N-(2-oxo-1-phenylpiperidin-3-yl)oxolane-2-carboxamide
CID 120793912

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-methyl-2-(4-methylphenyl)-N-(2-oxo-1-phenylpiperidin-3-yl)acetamide?
The IUPAC name of 2-amino-N-methyl-2-(4-methylphenyl)-N-(2-oxo-1-phenylpiperidin-3-yl)acetamide (CID 120668615) is 2-amino-N-methyl-2-(4-methylphenyl)-N-(2-oxo-1-phenylpiperidin-3-yl)acetamide.
What is the SMILES notation for 2-amino-N-methyl-2-(4-methylphenyl)-N-(2-oxo-1-phenylpiperidin-3-yl)acetamide?
The canonical SMILES for 2-amino-N-methyl-2-(4-methylphenyl)-N-(2-oxo-1-phenylpiperidin-3-yl)acetamide is Cc1ccc(C(N)C(=O)N(C)C2CCCN(c3ccccc3)C2=O)cc1.
What is the InChIKey of 2-amino-N-methyl-2-(4-methylphenyl)-N-(2-oxo-1-phenylpiperidin-3-yl)acetamide?
The InChIKey is RKNYSACQWJCKPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N3O2/c1-15-10-12-16(13-11-15)19(22)21(26)23(2)18-9-6-14-24(20(18)25)17-7-4-3-5-8-17/h3-5,7-8,10-13,18-19H,6,9,14,22H2,1-2H3.
What are the key properties of 2-amino-N-methyl-2-(4-methylphenyl)-N-(2-oxo-1-phenylpiperidin-3-yl)acetamide?
2-amino-N-methyl-2-(4-methylphenyl)-N-(2-oxo-1-phenylpiperidin-3-yl)acetamide has a molecular weight of 351.45 g/mol, XLogP of 2.65, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-methyl-2-(4-methylphenyl)-N-(2-oxo-1-phenylpiperidin-3-yl)acetamide is sourced from PubChem (CID 120668615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).