N-(3-ethoxycyclobutyl)-6-(methylamino)pyrazine-2-carboxamide

C12H18N4O2 — CID 114120777

IUPACN-(3-ethoxycyclobutyl)-6-(methylamino)pyrazine-2-carboxamide
SMILESCCOC1CC(NC(=O)c2cncc(NC)n2)C1
InChIInChI=1S/C12H18N4O2/c1-3-18-9-4-8(5-9)15-12(17)10-6-14-7-11(13-2)16-10/h6-9H,3-5H2,1-2H3,(H,13,16)(H,15,17)
InChIKeyPWULPRDQXMCQLN-UHFFFAOYSA-N
MW250.30 g/mol
LogP0.82
Rot. Bonds5

About N-(3-ethoxycyclobutyl)-6-(methylamino)pyrazine-2-carboxamide

N-(3-ethoxycyclobutyl)-6-(methylamino)pyrazine-2-carboxamide (PubChem CID 114120777) has the molecular formula C12H18N4O2 and a molecular weight of 250.30 g/mol. Its IUPAC name is N-(3-ethoxycyclobutyl)-6-(methylamino)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(3-ethoxycyclobutyl)-6-(methylamino)pyrazine-2-carboxamide
PubChem CID114120777
Molecular FormulaC12H18N4O2
Molecular Weight250.30 g/mol
Exact Mass250.14
IUPAC NameN-(3-ethoxycyclobutyl)-6-(methylamino)pyrazine-2-carboxamide
SMILESCCOC1CC(NC(=O)c2cncc(NC)n2)C1
InChIInChI=1S/C12H18N4O2/c1-3-18-9-4-8(5-9)15-12(17)10-6-14-7-11(13-2)16-10/h6-9H,3-5H2,1-2H3,(H,13,16)(H,15,17)
InChIKeyPWULPRDQXMCQLN-UHFFFAOYSA-N
XLogP0.82
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 50.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-(methylamino)-N-(4-methylcyclohexyl)pyrazine-2-carboxamide
CID 114035620
N-(2,3-dimethylcyclopentyl)-6-(methylamino)pyrazine-2-carboxamide
CID 114035970
6-chloro-N-(3-ethoxycyclobutyl)pyridine-3-carboxamide
CID 102610570
2-[4-[(3-ethoxycyclobutyl)carbamoyl]triazol-1-yl]acetic acid
CID 114120646
2,5-dichloro-N-(3-ethoxycyclobutyl)pyridine-4-carboxamide
CID 102612131
N-(3-ethoxycyclobutyl)-4-iodobenzamide
CID 102610594
N-(3-ethoxycyclobutyl)-1H-indole-3-carboxamide
CID 102673960
N-(3-ethoxycyclobutyl)-1H-indole-2-carboxamide
CID 102612122
4-cyano-N-(3-ethoxycyclobutyl)benzamide
CID 102610611
N-cyclopentyl-N-ethyl-6-(methylamino)pyrazine-2-carboxamide
CID 114035750
5-chloro-N-(3-ethoxycyclobutyl)-2-fluorobenzamide
CID 102610577
N-(3-ethoxycyclobutyl)-4-sulfamoylbenzamide
CID 102610643

Frequently Asked Questions

What is the IUPAC name of N-(3-ethoxycyclobutyl)-6-(methylamino)pyrazine-2-carboxamide?
The IUPAC name of N-(3-ethoxycyclobutyl)-6-(methylamino)pyrazine-2-carboxamide (CID 114120777) is N-(3-ethoxycyclobutyl)-6-(methylamino)pyrazine-2-carboxamide.
What is the SMILES notation for N-(3-ethoxycyclobutyl)-6-(methylamino)pyrazine-2-carboxamide?
The canonical SMILES for N-(3-ethoxycyclobutyl)-6-(methylamino)pyrazine-2-carboxamide is CCOC1CC(NC(=O)c2cncc(NC)n2)C1.
What is the InChIKey of N-(3-ethoxycyclobutyl)-6-(methylamino)pyrazine-2-carboxamide?
The InChIKey is PWULPRDQXMCQLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O2/c1-3-18-9-4-8(5-9)15-12(17)10-6-14-7-11(13-2)16-10/h6-9H,3-5H2,1-2H3,(H,13,16)(H,15,17).
What are the key properties of N-(3-ethoxycyclobutyl)-6-(methylamino)pyrazine-2-carboxamide?
N-(3-ethoxycyclobutyl)-6-(methylamino)pyrazine-2-carboxamide has a molecular weight of 250.30 g/mol, XLogP of 0.82, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethoxycyclobutyl)-6-(methylamino)pyrazine-2-carboxamide is sourced from PubChem (CID 114120777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).