N-(1-benzyl-2-methylpiperidin-4-yl)-4-methyl-3-oxopiperazine-1-carboxamide

C19H28N4O2 — CID 122137724

IUPACN-(1-benzyl-2-methylpiperidin-4-yl)-4-methyl-3-oxopiperazine-1-carboxamide
SMILESCC1CC(NC(=O)N2CCN(C)C(=O)C2)CCN1Cc1ccccc1
InChIInChI=1S/C19H28N4O2/c1-15-12-17(8-9-22(15)13-16-6-4-3-5-7-16)20-19(25)23-11-10-21(2)18(24)14-23/h3-7,15,17H,8-14H2,1-2H3,(H,20,25)
InChIKeyOABYIVOALOMORE-UHFFFAOYSA-N
MW344.46 g/mol
LogP1.52
Rot. Bonds3

About N-(1-benzyl-2-methylpiperidin-4-yl)-4-methyl-3-oxopiperazine-1-carboxamide

N-(1-benzyl-2-methylpiperidin-4-yl)-4-methyl-3-oxopiperazine-1-carboxamide (PubChem CID 122137724) has the molecular formula C19H28N4O2 and a molecular weight of 344.46 g/mol. Its IUPAC name is N-(1-benzyl-2-methylpiperidin-4-yl)-4-methyl-3-oxopiperazine-1-carboxamide.

Molecular Properties

Compound NameN-(1-benzyl-2-methylpiperidin-4-yl)-4-methyl-3-oxopiperazine-1-carboxamide
PubChem CID122137724
Molecular FormulaC19H28N4O2
Molecular Weight344.46 g/mol
Exact Mass344.22
IUPAC NameN-(1-benzyl-2-methylpiperidin-4-yl)-4-methyl-3-oxopiperazine-1-carboxamide
SMILESCC1CC(NC(=O)N2CCN(C)C(=O)C2)CCN1Cc1ccccc1
InChIInChI=1S/C19H28N4O2/c1-15-12-17(8-9-22(15)13-16-6-4-3-5-7-16)20-19(25)23-11-10-21(2)18(24)14-23/h3-7,15,17H,8-14H2,1-2H3,(H,20,25)
InChIKeyOABYIVOALOMORE-UHFFFAOYSA-N
XLogP1.52
TPSA55.89 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.46
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(1-benzyl-2-methylpiperidin-4-yl)-4-methyl-3-oxopiperazine-1-carboxamide 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-[(2R,4S)-1-benzyl-2-methylpiperidin-4-yl]acetamide
CID 124692107
N-(1-benzyl-2-methylpiperidin-4-yl)-3-bromoprop-2-ynamide
CID 131167223
N-(1-benzyl-2-methylpiperidin-4-yl)-2-hydroxy-2-phenylacetamide
CID 71860677
1-amino-3-(1-benzyl-2-methylpiperidin-4-yl)thiourea
CID 130834689
N-(1-benzyl-2-methylpiperidin-4-yl)-2-cyanoacetamide
CID 165351593
1-(1-benzyl-2-methylpiperidin-4-yl)-3-(2-oxopiperidin-3-yl)urea
CID 71923796
1-(1-benzyl-2-methylpiperidin-4-yl)-3-[(1-hydroxycyclopentyl)methyl]urea
CID 111861088
N-(1-benzyl-2-methylpiperidin-4-yl)-2-cyclopent-2-en-1-ylacetamide
CID 166228361
N,1-dibenzyl-2-methylpiperidin-4-amine
CID 119029011
N-(1-benzyl-2-methylpiperidin-4-yl)-3-piperidin-3-ylbutanamide
CID 119877367
N-[(2S,4S)-1-benzyl-2-methylpiperidin-4-yl]-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide
CID 96530121
3-(2-aminophenyl)-N-(1-benzyl-2-methylpiperidin-4-yl)propanamide;dihydrochloride
CID 120612982

Frequently Asked Questions

What is the IUPAC name of N-(1-benzyl-2-methylpiperidin-4-yl)-4-methyl-3-oxopiperazine-1-carboxamide?
The IUPAC name of N-(1-benzyl-2-methylpiperidin-4-yl)-4-methyl-3-oxopiperazine-1-carboxamide (CID 122137724) is N-(1-benzyl-2-methylpiperidin-4-yl)-4-methyl-3-oxopiperazine-1-carboxamide.
What is the SMILES notation for N-(1-benzyl-2-methylpiperidin-4-yl)-4-methyl-3-oxopiperazine-1-carboxamide?
The canonical SMILES for N-(1-benzyl-2-methylpiperidin-4-yl)-4-methyl-3-oxopiperazine-1-carboxamide is CC1CC(NC(=O)N2CCN(C)C(=O)C2)CCN1Cc1ccccc1.
What is the InChIKey of N-(1-benzyl-2-methylpiperidin-4-yl)-4-methyl-3-oxopiperazine-1-carboxamide?
The InChIKey is OABYIVOALOMORE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N4O2/c1-15-12-17(8-9-22(15)13-16-6-4-3-5-7-16)20-19(25)23-11-10-21(2)18(24)14-23/h3-7,15,17H,8-14H2,1-2H3,(H,20,25).
What are the key properties of N-(1-benzyl-2-methylpiperidin-4-yl)-4-methyl-3-oxopiperazine-1-carboxamide?
N-(1-benzyl-2-methylpiperidin-4-yl)-4-methyl-3-oxopiperazine-1-carboxamide has a molecular weight of 344.46 g/mol, XLogP of 1.52, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzyl-2-methylpiperidin-4-yl)-4-methyl-3-oxopiperazine-1-carboxamide is sourced from PubChem (CID 122137724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).