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

C12H18N4O — CID 110269424

IUPACN,3-dimethyl-1-pyrazin-2-ylpiperidine-3-carboxamide
SMILESCNC(=O)C1(C)CCCN(c2cnccn2)C1
InChIInChI=1S/C12H18N4O/c1-12(11(17)13-2)4-3-7-16(9-12)10-8-14-5-6-15-10/h5-6,8H,3-4,7,9H2,1-2H3,(H,13,17)
InChIKeySLMRZTPAUZZWIR-UHFFFAOYSA-N
MW234.30 g/mol
LogP0.83
Rot. Bonds2

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

N,3-dimethyl-1-pyrazin-2-ylpiperidine-3-carboxamide (PubChem CID 110269424) has the molecular formula C12H18N4O and a molecular weight of 234.30 g/mol. Its IUPAC name is N,3-dimethyl-1-pyrazin-2-ylpiperidine-3-carboxamide.

Molecular Properties

Compound NameN,3-dimethyl-1-pyrazin-2-ylpiperidine-3-carboxamide
PubChem CID110269424
Molecular FormulaC12H18N4O
Molecular Weight234.30 g/mol
Exact Mass234.15
IUPAC NameN,3-dimethyl-1-pyrazin-2-ylpiperidine-3-carboxamide
SMILESCNC(=O)C1(C)CCCN(c2cnccn2)C1
InChIInChI=1S/C12H18N4O/c1-12(11(17)13-2)4-3-7-16(9-12)10-8-14-5-6-15-10/h5-6,8H,3-4,7,9H2,1-2H3,(H,13,17)
InChIKeySLMRZTPAUZZWIR-UHFFFAOYSA-N
XLogP0.83
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 50.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,3-dimethyl-1-pyrazin-2-ylpiperidine-3-carboxamide?
The IUPAC name of N,3-dimethyl-1-pyrazin-2-ylpiperidine-3-carboxamide (CID 110269424) is N,3-dimethyl-1-pyrazin-2-ylpiperidine-3-carboxamide.
What is the SMILES notation for N,3-dimethyl-1-pyrazin-2-ylpiperidine-3-carboxamide?
The canonical SMILES for N,3-dimethyl-1-pyrazin-2-ylpiperidine-3-carboxamide is CNC(=O)C1(C)CCCN(c2cnccn2)C1.
What is the InChIKey of N,3-dimethyl-1-pyrazin-2-ylpiperidine-3-carboxamide?
The InChIKey is SLMRZTPAUZZWIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O/c1-12(11(17)13-2)4-3-7-16(9-12)10-8-14-5-6-15-10/h5-6,8H,3-4,7,9H2,1-2H3,(H,13,17).
What are the key properties of N,3-dimethyl-1-pyrazin-2-ylpiperidine-3-carboxamide?
N,3-dimethyl-1-pyrazin-2-ylpiperidine-3-carboxamide has a molecular weight of 234.30 g/mol, XLogP of 0.83, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-dimethyl-1-pyrazin-2-ylpiperidine-3-carboxamide is sourced from PubChem (CID 110269424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).