3,5-dimethyl-N-pyrazin-2-ylpiperidine-1-carboxamide

C12H18N4O — CID 108893834

IUPAC3,5-dimethyl-N-pyrazin-2-ylpiperidine-1-carboxamide
SMILESCC1CC(C)CN(C(=O)Nc2cnccn2)C1
InChIInChI=1S/C12H18N4O/c1-9-5-10(2)8-16(7-9)12(17)15-11-6-13-3-4-14-11/h3-4,6,9-10H,5,7-8H2,1-2H3,(H,14,15,17)
InChIKeyFXMUEPVMICNOSR-UHFFFAOYSA-N
MW234.30 g/mol
LogP1.99
Rot. Bonds1

About 3,5-dimethyl-N-pyrazin-2-ylpiperidine-1-carboxamide

3,5-dimethyl-N-pyrazin-2-ylpiperidine-1-carboxamide (PubChem CID 108893834) has the molecular formula C12H18N4O and a molecular weight of 234.30 g/mol. Its IUPAC name is 3,5-dimethyl-N-pyrazin-2-ylpiperidine-1-carboxamide.

Molecular Properties

Compound Name3,5-dimethyl-N-pyrazin-2-ylpiperidine-1-carboxamide
PubChem CID108893834
Molecular FormulaC12H18N4O
Molecular Weight234.30 g/mol
Exact Mass234.15
IUPAC Name3,5-dimethyl-N-pyrazin-2-ylpiperidine-1-carboxamide
SMILESCC1CC(C)CN(C(=O)Nc2cnccn2)C1
InChIInChI=1S/C12H18N4O/c1-9-5-10(2)8-16(7-9)12(17)15-11-6-13-3-4-14-11/h3-4,6,9-10H,5,7-8H2,1-2H3,(H,14,15,17)
InChIKeyFXMUEPVMICNOSR-UHFFFAOYSA-N
XLogP1.99
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-pyrazin-2-ylpyrrolidine-1-carboxamide
CID 110492109
N-pyrazin-2-ylazepane-1-carboxamide
CID 110492146
1-N-pyrazin-2-ylpiperidine-1,4-dicarboxamide
CID 110492224
3,4-dimethyl-N'-pyrazin-2-ylpiperidine-1-carbohydrazide
CID 139313951
4-(2-methoxyphenyl)-N-pyrazin-2-ylpiperazine-1-carboxamide
CID 110492522
(3R,4R)-4-methyl-N-pyrazin-2-yl-3-(1,5,7,11-tetrazatricyclo[7.3.0.02,6]dodeca-2(6),3,7,9,11-pentaen-12-yl)piperidine-1-carboxamide
CID 67999696
N-pyrazin-2-yl-2,7-diazaspiro[4.4]nonane-2-carboxamide
CID 110492221
1-(3,5-dimethylpiperidin-1-yl)-2-[methyl(pyrazin-2-ylmethyl)amino]ethanone
CID 75377018
2-morpholin-4-yl-2-oxo-N-pyrazin-2-ylacetamide
CID 117061770
(3S,5S)-N-(3,4-dichlorophenyl)-3,5-dimethylpiperidine-1-carboxamide
CID 840585
4-methyl-N-pyridin-2-ylpiperidine-1-carboxamide
CID 47266968
3,5-dimethyl-N-(1-methyl-5-phenylpyrazol-3-yl)piperidine-1-carboxamide
CID 108813000

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-N-pyrazin-2-ylpiperidine-1-carboxamide?
The IUPAC name of 3,5-dimethyl-N-pyrazin-2-ylpiperidine-1-carboxamide (CID 108893834) is 3,5-dimethyl-N-pyrazin-2-ylpiperidine-1-carboxamide.
What is the SMILES notation for 3,5-dimethyl-N-pyrazin-2-ylpiperidine-1-carboxamide?
The canonical SMILES for 3,5-dimethyl-N-pyrazin-2-ylpiperidine-1-carboxamide is CC1CC(C)CN(C(=O)Nc2cnccn2)C1.
What is the InChIKey of 3,5-dimethyl-N-pyrazin-2-ylpiperidine-1-carboxamide?
The InChIKey is FXMUEPVMICNOSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O/c1-9-5-10(2)8-16(7-9)12(17)15-11-6-13-3-4-14-11/h3-4,6,9-10H,5,7-8H2,1-2H3,(H,14,15,17).
What are the key properties of 3,5-dimethyl-N-pyrazin-2-ylpiperidine-1-carboxamide?
3,5-dimethyl-N-pyrazin-2-ylpiperidine-1-carboxamide has a molecular weight of 234.30 g/mol, XLogP of 1.99, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-N-pyrazin-2-ylpiperidine-1-carboxamide is sourced from PubChem (CID 108893834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).