1-methyl-N-pyridin-4-ylpiperazine-2-carboxamide

C11H16N4O — CID 115177729

IUPAC1-methyl-N-pyridin-4-ylpiperazine-2-carboxamide
SMILESCN1CCNCC1C(=O)Nc1ccncc1
InChIInChI=1S/C11H16N4O/c1-15-7-6-13-8-10(15)11(16)14-9-2-4-12-5-3-9/h2-5,10,13H,6-8H2,1H3,(H,12,14,16)
InChIKeyMKPOWTHHBMDFNY-UHFFFAOYSA-N
MW220.28 g/mol
LogP-0.08
Rot. Bonds2

About 1-methyl-N-pyridin-4-ylpiperazine-2-carboxamide

1-methyl-N-pyridin-4-ylpiperazine-2-carboxamide (PubChem CID 115177729) has the molecular formula C11H16N4O and a molecular weight of 220.28 g/mol. Its IUPAC name is 1-methyl-N-pyridin-4-ylpiperazine-2-carboxamide.

Molecular Properties

Compound Name1-methyl-N-pyridin-4-ylpiperazine-2-carboxamide
PubChem CID115177729
Molecular FormulaC11H16N4O
Molecular Weight220.28 g/mol
Exact Mass220.13
IUPAC Name1-methyl-N-pyridin-4-ylpiperazine-2-carboxamide
SMILESCN1CCNCC1C(=O)Nc1ccncc1
InChIInChI=1S/C11H16N4O/c1-15-7-6-13-8-10(15)11(16)14-9-2-4-12-5-3-9/h2-5,10,13H,6-8H2,1H3,(H,12,14,16)
InChIKeyMKPOWTHHBMDFNY-UHFFFAOYSA-N
XLogP-0.08
TPSA57.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.28
LogP ≤ 5-0.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 1-methyl-N-pyridin-4-ylpiperazine-2-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

N-pyridin-4-ylpyrrolidine-3-carboxamide
CID 63005932
(1-methylpiperazin-2-yl)-(1H-pyrrol-3-yl)methanone
CID 116919723
(2S)-N-(4-fluorophenyl)-1-(2-pyridin-4-ylsulfanylacetyl)piperazine-2-carboxamide
CID 95723495
1-methyl-N-(thiophen-2-ylmethyl)piperazine-2-carboxamide
CID 115177787
(4-chlorophenyl)-(1-methylpiperazin-2-yl)methanone
CID 116919681
N-[2-(1-methylpiperazin-2-yl)ethyl]pyridin-4-amine
CID 115239546
(2R)-1-methyl-2-pyridin-4-ylpiperazine
CID 28804916
N-pyridin-4-ylazetidine-2-carboxamide
CID 130908968
1-methyl-N-(2-thiophen-2-ylethyl)piperazine-2-carboxamide
CID 115177853
(2R)-N-cyclobutyl-1-methylpiperazine-2-carboxamide
CID 89103840
2-[2-(1-methylimidazol-2-yl)piperazin-1-yl]-N-pyridin-4-ylacetamide
CID 120870641
1-methyl-N-[(5-methylfuran-2-yl)methyl]piperazine-2-carboxamide
CID 115177813

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-pyridin-4-ylpiperazine-2-carboxamide?
The IUPAC name of 1-methyl-N-pyridin-4-ylpiperazine-2-carboxamide (CID 115177729) is 1-methyl-N-pyridin-4-ylpiperazine-2-carboxamide.
What is the SMILES notation for 1-methyl-N-pyridin-4-ylpiperazine-2-carboxamide?
The canonical SMILES for 1-methyl-N-pyridin-4-ylpiperazine-2-carboxamide is CN1CCNCC1C(=O)Nc1ccncc1.
What is the InChIKey of 1-methyl-N-pyridin-4-ylpiperazine-2-carboxamide?
The InChIKey is MKPOWTHHBMDFNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O/c1-15-7-6-13-8-10(15)11(16)14-9-2-4-12-5-3-9/h2-5,10,13H,6-8H2,1H3,(H,12,14,16).
What are the key properties of 1-methyl-N-pyridin-4-ylpiperazine-2-carboxamide?
1-methyl-N-pyridin-4-ylpiperazine-2-carboxamide has a molecular weight of 220.28 g/mol, XLogP of -0.08, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-pyridin-4-ylpiperazine-2-carboxamide is sourced from PubChem (CID 115177729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).