N-methyl-N,4-diphenylpiperazine-1-carboxamide

C18H21N3O — CID 890140

IUPACN-methyl-N,4-diphenylpiperazine-1-carboxamide
SMILESCN(C(=O)N1CCN(c2ccccc2)CC1)c1ccccc1
InChIInChI=1S/C18H21N3O/c1-19(16-8-4-2-5-9-16)18(22)21-14-12-20(13-15-21)17-10-6-3-7-11-17/h2-11H,12-15H2,1H3
InChIKeyVFKQNFHVTRDOQW-UHFFFAOYSA-N
MW295.39 g/mol
LogP3.07
Rot. Bonds2

About N-methyl-N,4-diphenylpiperazine-1-carboxamide

N-methyl-N,4-diphenylpiperazine-1-carboxamide (PubChem CID 890140) has the molecular formula C18H21N3O and a molecular weight of 295.39 g/mol. Its IUPAC name is N-methyl-N,4-diphenylpiperazine-1-carboxamide.

Molecular Properties

Compound NameN-methyl-N,4-diphenylpiperazine-1-carboxamide
PubChem CID890140
Molecular FormulaC18H21N3O
Molecular Weight295.39 g/mol
Exact Mass295.17
IUPAC NameN-methyl-N,4-diphenylpiperazine-1-carboxamide
SMILESCN(C(=O)N1CCN(c2ccccc2)CC1)c1ccccc1
InChIInChI=1S/C18H21N3O/c1-19(16-8-4-2-5-9-16)18(22)21-14-12-20(13-15-21)17-10-6-3-7-11-17/h2-11H,12-15H2,1H3
InChIKeyVFKQNFHVTRDOQW-UHFFFAOYSA-N
XLogP3.07
TPSA26.79 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.39
LogP ≤ 53.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-3-oxo-N-phenyl-3-(4-phenylpiperazin-1-yl)propanamide
CID 108949403
N-ethyl-N,4-diphenylpiperazine-1-carboxamide
CID 108989539
N-methyl-N-phenylpiperidine-1-carboxamide
CID 54133936
1-[methyl(phenyl)carbamoyl]piperidine-4-carboxylic acid
CID 28513181
N-methyl-4-methylsulfinyl-N-phenylpiperazine-1-carboxamide
CID 169107036
N-ethyl-2-oxo-N-phenyl-2-(4-phenylpiperazin-1-yl)acetamide
CID 108518692
2-[4-(4-methoxyphenyl)piperazin-1-yl]-N-methyl-2-oxo-N-phenylacetamide
CID 108986682
[3-(dimethylamino)phenyl]-(4-phenylpiperazin-1-yl)methanone
CID 2598413
4-[4-(cyclopropanecarbonyl)piperazin-1-yl]-N-methyl-N-phenylbenzamide
CID 110417503
2-oxo-2-(4-phenylpiperazin-1-yl)acetate
CID 2051799
N-(dimethylaminomethylidene)-4-phenylpiperazine-1-carboxamide
CID 3771212
[2-(N-methylanilino)pyrimidin-5-yl]-(4-phenylpiperazin-1-yl)methanone
CID 109261118

Frequently Asked Questions

What is the IUPAC name of N-methyl-N,4-diphenylpiperazine-1-carboxamide?
The IUPAC name of N-methyl-N,4-diphenylpiperazine-1-carboxamide (CID 890140) is N-methyl-N,4-diphenylpiperazine-1-carboxamide.
What is the SMILES notation for N-methyl-N,4-diphenylpiperazine-1-carboxamide?
The canonical SMILES for N-methyl-N,4-diphenylpiperazine-1-carboxamide is CN(C(=O)N1CCN(c2ccccc2)CC1)c1ccccc1.
What is the InChIKey of N-methyl-N,4-diphenylpiperazine-1-carboxamide?
The InChIKey is VFKQNFHVTRDOQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O/c1-19(16-8-4-2-5-9-16)18(22)21-14-12-20(13-15-21)17-10-6-3-7-11-17/h2-11H,12-15H2,1H3.
What are the key properties of N-methyl-N,4-diphenylpiperazine-1-carboxamide?
N-methyl-N,4-diphenylpiperazine-1-carboxamide has a molecular weight of 295.39 g/mol, XLogP of 3.07, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N,4-diphenylpiperazine-1-carboxamide is sourced from PubChem (CID 890140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).