6-amino-N-[(1-ethylcyclopentyl)methyl]pyrazine-2-carboxamide

C13H20N4O — CID 114126499

IUPAC6-amino-N-[(1-ethylcyclopentyl)methyl]pyrazine-2-carboxamide
SMILESCCC1(CNC(=O)c2cncc(N)n2)CCCC1
InChIInChI=1S/C13H20N4O/c1-2-13(5-3-4-6-13)9-16-12(18)10-7-15-8-11(14)17-10/h7-8H,2-6,9H2,1H3,(H2,14,17)(H,16,18)
InChIKeyNRMQDVBULRNJGN-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.76
Rot. Bonds4

About 6-amino-N-[(1-ethylcyclopentyl)methyl]pyrazine-2-carboxamide

6-amino-N-[(1-ethylcyclopentyl)methyl]pyrazine-2-carboxamide (PubChem CID 114126499) has the molecular formula C13H20N4O and a molecular weight of 248.33 g/mol. Its IUPAC name is 6-amino-N-[(1-ethylcyclopentyl)methyl]pyrazine-2-carboxamide.

Molecular Properties

Compound Name6-amino-N-[(1-ethylcyclopentyl)methyl]pyrazine-2-carboxamide
PubChem CID114126499
Molecular FormulaC13H20N4O
Molecular Weight248.33 g/mol
Exact Mass248.16
IUPAC Name6-amino-N-[(1-ethylcyclopentyl)methyl]pyrazine-2-carboxamide
SMILESCCC1(CNC(=O)c2cncc(N)n2)CCCC1
InChIInChI=1S/C13H20N4O/c1-2-13(5-3-4-6-13)9-16-12(18)10-7-15-8-11(14)17-10/h7-8H,2-6,9H2,1H3,(H2,14,17)(H,16,18)
InChIKeyNRMQDVBULRNJGN-UHFFFAOYSA-N
XLogP1.76
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-amino-N-[(1-propylcyclopropyl)methyl]pyrazine-2-carboxamide
CID 114101902
6-amino-N-[(2-methylthiolan-2-yl)methyl]pyrazine-2-carboxamide
CID 114036016
6-amino-N-[(2-methyloxolan-2-yl)methyl]pyrazine-2-carboxamide
CID 114036007
6-amino-N-[(1-ethylcyclopropyl)methyl]pyridine-2-carboxamide;hydrochloride
CID 119999117
2-(aminomethyl)-N-[(1-ethylcyclopentyl)methyl]-1,3-thiazole-4-carboxamide;hydrochloride
CID 119812243
4-amino-N-[(1-ethylcyclopentyl)methyl]benzamide;hydrochloride
CID 119812226
6-amino-N-(4,4-dimethylcyclohexyl)pyrazine-2-carboxamide
CID 114035957
4-amino-1-ethyl-N-[(1-ethylcyclobutyl)methyl]pyrazole-5-carboxamide
CID 114107088
6-amino-N-[2-[cyclopropyl(ethyl)amino]ethyl]pyrazine-2-carboxamide
CID 114134895
1-(6-aminopyrazin-2-yl)ethanone
CID 146315593
5-chloro-N-[(1-ethylcyclopropyl)methyl]pyrazine-2-carboxamide
CID 107257972
2-amino-N-[(1-ethylcyclobutyl)methyl]benzamide
CID 103822063

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-[(1-ethylcyclopentyl)methyl]pyrazine-2-carboxamide?
The IUPAC name of 6-amino-N-[(1-ethylcyclopentyl)methyl]pyrazine-2-carboxamide (CID 114126499) is 6-amino-N-[(1-ethylcyclopentyl)methyl]pyrazine-2-carboxamide.
What is the SMILES notation for 6-amino-N-[(1-ethylcyclopentyl)methyl]pyrazine-2-carboxamide?
The canonical SMILES for 6-amino-N-[(1-ethylcyclopentyl)methyl]pyrazine-2-carboxamide is CCC1(CNC(=O)c2cncc(N)n2)CCCC1.
What is the InChIKey of 6-amino-N-[(1-ethylcyclopentyl)methyl]pyrazine-2-carboxamide?
The InChIKey is NRMQDVBULRNJGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O/c1-2-13(5-3-4-6-13)9-16-12(18)10-7-15-8-11(14)17-10/h7-8H,2-6,9H2,1H3,(H2,14,17)(H,16,18).
What are the key properties of 6-amino-N-[(1-ethylcyclopentyl)methyl]pyrazine-2-carboxamide?
6-amino-N-[(1-ethylcyclopentyl)methyl]pyrazine-2-carboxamide has a molecular weight of 248.33 g/mol, XLogP of 1.76, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-[(1-ethylcyclopentyl)methyl]pyrazine-2-carboxamide is sourced from PubChem (CID 114126499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).