N-(2,6-diethylphenyl)piperazine-1-carboxamide

C15H23N3O — CID 82090590

IUPACN-(2,6-diethylphenyl)piperazine-1-carboxamide
SMILESCCc1cccc(CC)c1NC(=O)N1CCNCC1
InChIInChI=1S/C15H23N3O/c1-3-12-6-5-7-13(4-2)14(12)17-15(19)18-10-8-16-9-11-18/h5-7,16H,3-4,8-11H2,1-2H3,(H,17,19)
InChIKeySIHSKVNIRARWGD-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.25
Rot. Bonds3

About N-(2,6-diethylphenyl)piperazine-1-carboxamide

N-(2,6-diethylphenyl)piperazine-1-carboxamide (PubChem CID 82090590) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is N-(2,6-diethylphenyl)piperazine-1-carboxamide.

Molecular Properties

Compound NameN-(2,6-diethylphenyl)piperazine-1-carboxamide
PubChem CID82090590
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC NameN-(2,6-diethylphenyl)piperazine-1-carboxamide
SMILESCCc1cccc(CC)c1NC(=O)N1CCNCC1
InChIInChI=1S/C15H23N3O/c1-3-12-6-5-7-13(4-2)14(12)17-15(19)18-10-8-16-9-11-18/h5-7,16H,3-4,8-11H2,1-2H3,(H,17,19)
InChIKeySIHSKVNIRARWGD-UHFFFAOYSA-N
XLogP2.25
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-ethyl-6-methylphenyl)piperazine-1-carboxamide
CID 82086576
4-tert-butyl-N-(2,6-diethylphenyl)piperazine-1-carboxamide
CID 113110317
N-(2,6-difluorophenyl)piperazine-1-carboxamide
CID 91552167
N-[2-(aminomethyl)phenyl]piperazine-1-carboxamide
CID 174500073
N-(2,3,5,6-tetramethylphenyl)piperazine-1-carboxamide
CID 82302374
N-(2,6-diethylphenyl)-4-(2-thiophen-2-ylethyl)piperazine-1-carboxamide
CID 3600955
1-[(2,6-diethylphenyl)carbamoyl]-5-methylpiperidine-3-carboxylic acid
CID 122101857
4-butyl-N-(2-ethyl-6-methylphenyl)piperazine-1-carboxamide
CID 113103802
N-(2-ethyl-6-methylphenyl)-4-pyridin-4-ylpiperazine-1-carboxamide
CID 86986479
2-N-(2,6-diethylphenyl)-1-N-propan-2-ylpyrazolidine-1,2-dicarboxamide
CID 3538975
N-(4-ethoxyphenyl)piperazine-1-carboxamide
CID 82087160
3-amino-N-(2,6-diethylphenyl)-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazole-5-carboxamide
CID 69163216

Frequently Asked Questions

What is the IUPAC name of N-(2,6-diethylphenyl)piperazine-1-carboxamide?
The IUPAC name of N-(2,6-diethylphenyl)piperazine-1-carboxamide (CID 82090590) is N-(2,6-diethylphenyl)piperazine-1-carboxamide.
What is the SMILES notation for N-(2,6-diethylphenyl)piperazine-1-carboxamide?
The canonical SMILES for N-(2,6-diethylphenyl)piperazine-1-carboxamide is CCc1cccc(CC)c1NC(=O)N1CCNCC1.
What is the InChIKey of N-(2,6-diethylphenyl)piperazine-1-carboxamide?
The InChIKey is SIHSKVNIRARWGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-3-12-6-5-7-13(4-2)14(12)17-15(19)18-10-8-16-9-11-18/h5-7,16H,3-4,8-11H2,1-2H3,(H,17,19).
What are the key properties of N-(2,6-diethylphenyl)piperazine-1-carboxamide?
N-(2,6-diethylphenyl)piperazine-1-carboxamide has a molecular weight of 261.37 g/mol, XLogP of 2.25, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-diethylphenyl)piperazine-1-carboxamide is sourced from PubChem (CID 82090590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).