N-(4-hydroxy-2-methylbutyl)pyrazine-2-carboxamide

C10H15N3O2 — CID 66106195

IUPACN-(4-hydroxy-2-methylbutyl)pyrazine-2-carboxamide
SMILESCC(CCO)CNC(=O)c1cnccn1
InChIInChI=1S/C10H15N3O2/c1-8(2-5-14)6-13-10(15)9-7-11-3-4-12-9/h3-4,7-8,14H,2,5-6H2,1H3,(H,13,15)
InChIKeyIVBMKECTYOAFHU-UHFFFAOYSA-N
MW209.25 g/mol
LogP0.22
Rot. Bonds5

About N-(4-hydroxy-2-methylbutyl)pyrazine-2-carboxamide

N-(4-hydroxy-2-methylbutyl)pyrazine-2-carboxamide (PubChem CID 66106195) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is N-(4-hydroxy-2-methylbutyl)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(4-hydroxy-2-methylbutyl)pyrazine-2-carboxamide
PubChem CID66106195
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC NameN-(4-hydroxy-2-methylbutyl)pyrazine-2-carboxamide
SMILESCC(CCO)CNC(=O)c1cnccn1
InChIInChI=1S/C10H15N3O2/c1-8(2-5-14)6-13-10(15)9-7-11-3-4-12-9/h3-4,7-8,14H,2,5-6H2,1H3,(H,13,15)
InChIKeyIVBMKECTYOAFHU-UHFFFAOYSA-N
XLogP0.22
TPSA75.11 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 50.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-hydroxy-2-methylbutyl)-1,3-thiazole-4-carboxamide
CID 66106843
N-(2-hydroxyethyl)pyrazine-2-carboxamide
CID 14230272
N-(3-methyl-2-oxobutyl)pyrazine-2-carboxamide
CID 103874912
N-(4-hydroxy-2-methylbutyl)-6-oxo-1H-pyrazine-3-carboxamide
CID 66109460
N-(2,2-diethoxyethyl)pyrazine-2-carboxamide
CID 103602082
2-[[2-(pyrazine-2-carbonylamino)acetyl]amino]propanoic acid
CID 14101217
(2S)-4-hydroxy-2-(pyrazine-2-carbonylamino)butanoic acid
CID 107822419
3-methoxy-4-(pyrazine-2-carbonylamino)butanoic acid
CID 103152974
N-(2,2-dimethylpropyl)pyrazine-2-carboxamide
CID 21060489
N-[10-(pyrazine-2-carbonylamino)decyl]pyrazine-2-carboxamide
CID 71517100
ethane;N-propan-2-ylpyrazine-2-carboxamide
CID 143147775
N-(5-hydroxypentyl)pyrazine-2-carboxamide
CID 108796814

Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxy-2-methylbutyl)pyrazine-2-carboxamide?
The IUPAC name of N-(4-hydroxy-2-methylbutyl)pyrazine-2-carboxamide (CID 66106195) is N-(4-hydroxy-2-methylbutyl)pyrazine-2-carboxamide.
What is the SMILES notation for N-(4-hydroxy-2-methylbutyl)pyrazine-2-carboxamide?
The canonical SMILES for N-(4-hydroxy-2-methylbutyl)pyrazine-2-carboxamide is CC(CCO)CNC(=O)c1cnccn1.
What is the InChIKey of N-(4-hydroxy-2-methylbutyl)pyrazine-2-carboxamide?
The InChIKey is IVBMKECTYOAFHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c1-8(2-5-14)6-13-10(15)9-7-11-3-4-12-9/h3-4,7-8,14H,2,5-6H2,1H3,(H,13,15).
What are the key properties of N-(4-hydroxy-2-methylbutyl)pyrazine-2-carboxamide?
N-(4-hydroxy-2-methylbutyl)pyrazine-2-carboxamide has a molecular weight of 209.25 g/mol, XLogP of 0.22, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxy-2-methylbutyl)pyrazine-2-carboxamide is sourced from PubChem (CID 66106195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).