N,5-dimethyl-N-[3-(1-methylimidazol-2-yl)propyl]pyrazine-2-carboxamide

C14H19N5O — CID 91782057

IUPACN,5-dimethyl-N-[3-(1-methylimidazol-2-yl)propyl]pyrazine-2-carboxamide
SMILESCc1cnc(C(=O)N(C)CCCc2nccn2C)cn1
InChIInChI=1S/C14H19N5O/c1-11-9-17-12(10-16-11)14(20)19(3)7-4-5-13-15-6-8-18(13)2/h6,8-10H,4-5,7H2,1-3H3
InChIKeyVTEQMHUSISAICT-UHFFFAOYSA-N
MW273.34 g/mol
LogP1.22
Rot. Bonds5

About N,5-dimethyl-N-[3-(1-methylimidazol-2-yl)propyl]pyrazine-2-carboxamide

N,5-dimethyl-N-[3-(1-methylimidazol-2-yl)propyl]pyrazine-2-carboxamide (PubChem CID 91782057) has the molecular formula C14H19N5O and a molecular weight of 273.34 g/mol. Its IUPAC name is N,5-dimethyl-N-[3-(1-methylimidazol-2-yl)propyl]pyrazine-2-carboxamide.

Molecular Properties

Compound NameN,5-dimethyl-N-[3-(1-methylimidazol-2-yl)propyl]pyrazine-2-carboxamide
PubChem CID91782057
Molecular FormulaC14H19N5O
Molecular Weight273.34 g/mol
Exact Mass273.16
IUPAC NameN,5-dimethyl-N-[3-(1-methylimidazol-2-yl)propyl]pyrazine-2-carboxamide
SMILESCc1cnc(C(=O)N(C)CCCc2nccn2C)cn1
InChIInChI=1S/C14H19N5O/c1-11-9-17-12(10-16-11)14(20)19(3)7-4-5-13-15-6-8-18(13)2/h6,8-10H,4-5,7H2,1-3H3
InChIKeyVTEQMHUSISAICT-UHFFFAOYSA-N
XLogP1.22
TPSA63.91 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 51.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,5-dimethyl-N-[3-(1-methylimidazol-2-yl)propyl]pyrazine-2-carboxamide?
The IUPAC name of N,5-dimethyl-N-[3-(1-methylimidazol-2-yl)propyl]pyrazine-2-carboxamide (CID 91782057) is N,5-dimethyl-N-[3-(1-methylimidazol-2-yl)propyl]pyrazine-2-carboxamide.
What is the SMILES notation for N,5-dimethyl-N-[3-(1-methylimidazol-2-yl)propyl]pyrazine-2-carboxamide?
The canonical SMILES for N,5-dimethyl-N-[3-(1-methylimidazol-2-yl)propyl]pyrazine-2-carboxamide is Cc1cnc(C(=O)N(C)CCCc2nccn2C)cn1.
What is the InChIKey of N,5-dimethyl-N-[3-(1-methylimidazol-2-yl)propyl]pyrazine-2-carboxamide?
The InChIKey is VTEQMHUSISAICT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5O/c1-11-9-17-12(10-16-11)14(20)19(3)7-4-5-13-15-6-8-18(13)2/h6,8-10H,4-5,7H2,1-3H3.
What are the key properties of N,5-dimethyl-N-[3-(1-methylimidazol-2-yl)propyl]pyrazine-2-carboxamide?
N,5-dimethyl-N-[3-(1-methylimidazol-2-yl)propyl]pyrazine-2-carboxamide has a molecular weight of 273.34 g/mol, XLogP of 1.22, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,5-dimethyl-N-[3-(1-methylimidazol-2-yl)propyl]pyrazine-2-carboxamide is sourced from PubChem (CID 91782057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).