N-cyclopropyl-5-(methylamino)-N-(thiophen-2-ylmethyl)pyrazine-2-carboxamide

C14H16N4OS — CID 107375295

IUPACN-cyclopropyl-5-(methylamino)-N-(thiophen-2-ylmethyl)pyrazine-2-carboxamide
SMILESCNc1cnc(C(=O)N(Cc2cccs2)C2CC2)cn1
InChIInChI=1S/C14H16N4OS/c1-15-13-8-16-12(7-17-13)14(19)18(10-4-5-10)9-11-3-2-6-20-11/h2-3,6-8,10H,4-5,9H2,1H3,(H,15,17)
InChIKeyBCVIRIORCDHWFF-UHFFFAOYSA-N
MW288.38 g/mol
LogP2.38
Rot. Bonds5

About N-cyclopropyl-5-(methylamino)-N-(thiophen-2-ylmethyl)pyrazine-2-carboxamide

N-cyclopropyl-5-(methylamino)-N-(thiophen-2-ylmethyl)pyrazine-2-carboxamide (PubChem CID 107375295) has the molecular formula C14H16N4OS and a molecular weight of 288.38 g/mol. Its IUPAC name is N-cyclopropyl-5-(methylamino)-N-(thiophen-2-ylmethyl)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-5-(methylamino)-N-(thiophen-2-ylmethyl)pyrazine-2-carboxamide
PubChem CID107375295
Molecular FormulaC14H16N4OS
Molecular Weight288.38 g/mol
Exact Mass288.10
IUPAC NameN-cyclopropyl-5-(methylamino)-N-(thiophen-2-ylmethyl)pyrazine-2-carboxamide
SMILESCNc1cnc(C(=O)N(Cc2cccs2)C2CC2)cn1
InChIInChI=1S/C14H16N4OS/c1-15-13-8-16-12(7-17-13)14(19)18(10-4-5-10)9-11-3-2-6-20-11/h2-3,6-8,10H,4-5,9H2,1H3,(H,15,17)
InChIKeyBCVIRIORCDHWFF-UHFFFAOYSA-N
XLogP2.38
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.38
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-5-(methylamino)-N-(2-thiophen-2-ylethyl)pyrazine-2-carboxamide
CID 107376172
N-cyclopropyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide
CID 62242780
6-amino-N-cyclopropyl-N-(thiophen-2-ylmethyl)pyridazine-3-carboxamide
CID 62186849
N-cyclopentyl-N-(2-hydroxyethyl)-5-(methylamino)pyrazine-2-carboxamide
CID 107375030
N-cyclopropyl-4-fluoro-N-(thiophen-2-ylmethyl)benzamide
CID 47024128
5-amino-N-cyclopropyl-2-methyl-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide
CID 61107609
N-cyclopropyl-6-oxo-N-(thiophen-2-ylmethyl)-1H-pyridine-3-carboxamide
CID 56811644
5-methyl-N-(oxan-4-yl)-N-(thiophen-2-ylmethyl)-1,2-oxazole-3-carboxamide
CID 90610768
N-cyclopropyl-N-(thiophen-2-ylmethyl)-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide
CID 134004580
3-tert-butyl-1-cyclopropyl-1-(thiophen-2-ylmethyl)urea
CID 113224633
3-bromo-N-cyclopropyl-N-(thiophen-2-ylmethyl)benzamide
CID 51889465
N-cyclopropyl-3-hydroxy-2-methyl-N-(thiophen-2-ylmethyl)benzamide
CID 82795082

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-5-(methylamino)-N-(thiophen-2-ylmethyl)pyrazine-2-carboxamide?
The IUPAC name of N-cyclopropyl-5-(methylamino)-N-(thiophen-2-ylmethyl)pyrazine-2-carboxamide (CID 107375295) is N-cyclopropyl-5-(methylamino)-N-(thiophen-2-ylmethyl)pyrazine-2-carboxamide.
What is the SMILES notation for N-cyclopropyl-5-(methylamino)-N-(thiophen-2-ylmethyl)pyrazine-2-carboxamide?
The canonical SMILES for N-cyclopropyl-5-(methylamino)-N-(thiophen-2-ylmethyl)pyrazine-2-carboxamide is CNc1cnc(C(=O)N(Cc2cccs2)C2CC2)cn1.
What is the InChIKey of N-cyclopropyl-5-(methylamino)-N-(thiophen-2-ylmethyl)pyrazine-2-carboxamide?
The InChIKey is BCVIRIORCDHWFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4OS/c1-15-13-8-16-12(7-17-13)14(19)18(10-4-5-10)9-11-3-2-6-20-11/h2-3,6-8,10H,4-5,9H2,1H3,(H,15,17).
What are the key properties of N-cyclopropyl-5-(methylamino)-N-(thiophen-2-ylmethyl)pyrazine-2-carboxamide?
N-cyclopropyl-5-(methylamino)-N-(thiophen-2-ylmethyl)pyrazine-2-carboxamide has a molecular weight of 288.38 g/mol, XLogP of 2.38, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-5-(methylamino)-N-(thiophen-2-ylmethyl)pyrazine-2-carboxamide is sourced from PubChem (CID 107375295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).