N-(cyclopropylmethyl)-5-methyl-N-(pyrrolidin-2-ylmethyl)pyrazine-2-carboxamide

C15H22N4O — CID 106608117

IUPACN-(cyclopropylmethyl)-5-methyl-N-(pyrrolidin-2-ylmethyl)pyrazine-2-carboxamide
SMILESCc1cnc(C(=O)N(CC2CC2)CC2CCCN2)cn1
InChIInChI=1S/C15H22N4O/c1-11-7-18-14(8-17-11)15(20)19(9-12-4-5-12)10-13-3-2-6-16-13/h7-8,12-13,16H,2-6,9-10H2,1H3
InChIKeyWXOURKIHLXFCST-UHFFFAOYSA-N
MW274.37 g/mol
LogP1.39
Rot. Bonds5

About N-(cyclopropylmethyl)-5-methyl-N-(pyrrolidin-2-ylmethyl)pyrazine-2-carboxamide

N-(cyclopropylmethyl)-5-methyl-N-(pyrrolidin-2-ylmethyl)pyrazine-2-carboxamide (PubChem CID 106608117) has the molecular formula C15H22N4O and a molecular weight of 274.37 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-5-methyl-N-(pyrrolidin-2-ylmethyl)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-5-methyl-N-(pyrrolidin-2-ylmethyl)pyrazine-2-carboxamide
PubChem CID106608117
Molecular FormulaC15H22N4O
Molecular Weight274.37 g/mol
Exact Mass274.18
IUPAC NameN-(cyclopropylmethyl)-5-methyl-N-(pyrrolidin-2-ylmethyl)pyrazine-2-carboxamide
SMILESCc1cnc(C(=O)N(CC2CC2)CC2CCCN2)cn1
InChIInChI=1S/C15H22N4O/c1-11-7-18-14(8-17-11)15(20)19(9-12-4-5-12)10-13-3-2-6-16-13/h7-8,12-13,16H,2-6,9-10H2,1H3
InChIKeyWXOURKIHLXFCST-UHFFFAOYSA-N
XLogP1.39
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.37
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-5-methyl-N-(pyrrolidin-2-ylmethyl)pyrazine-2-carboxamide?
The IUPAC name of N-(cyclopropylmethyl)-5-methyl-N-(pyrrolidin-2-ylmethyl)pyrazine-2-carboxamide (CID 106608117) is N-(cyclopropylmethyl)-5-methyl-N-(pyrrolidin-2-ylmethyl)pyrazine-2-carboxamide.
What is the SMILES notation for N-(cyclopropylmethyl)-5-methyl-N-(pyrrolidin-2-ylmethyl)pyrazine-2-carboxamide?
The canonical SMILES for N-(cyclopropylmethyl)-5-methyl-N-(pyrrolidin-2-ylmethyl)pyrazine-2-carboxamide is Cc1cnc(C(=O)N(CC2CC2)CC2CCCN2)cn1.
What is the InChIKey of N-(cyclopropylmethyl)-5-methyl-N-(pyrrolidin-2-ylmethyl)pyrazine-2-carboxamide?
The InChIKey is WXOURKIHLXFCST-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O/c1-11-7-18-14(8-17-11)15(20)19(9-12-4-5-12)10-13-3-2-6-16-13/h7-8,12-13,16H,2-6,9-10H2,1H3.
What are the key properties of N-(cyclopropylmethyl)-5-methyl-N-(pyrrolidin-2-ylmethyl)pyrazine-2-carboxamide?
N-(cyclopropylmethyl)-5-methyl-N-(pyrrolidin-2-ylmethyl)pyrazine-2-carboxamide has a molecular weight of 274.37 g/mol, XLogP of 1.39, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-5-methyl-N-(pyrrolidin-2-ylmethyl)pyrazine-2-carboxamide is sourced from PubChem (CID 106608117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).