N-(1-amino-4-methylpentan-2-yl)pyrazine-2-carboxamide

C11H18N4O — CID 63888138

IUPACN-(1-amino-4-methylpentan-2-yl)pyrazine-2-carboxamide
SMILESCC(C)CC(CN)NC(=O)c1cnccn1
InChIInChI=1S/C11H18N4O/c1-8(2)5-9(6-12)15-11(16)10-7-13-3-4-14-10/h3-4,7-9H,5-6,12H2,1-2H3,(H,15,16)
InChIKeyPZBAJGCNWRQQKT-UHFFFAOYSA-N
MW222.29 g/mol
LogP0.58
Rot. Bonds5

About N-(1-amino-4-methylpentan-2-yl)pyrazine-2-carboxamide

N-(1-amino-4-methylpentan-2-yl)pyrazine-2-carboxamide (PubChem CID 63888138) has the molecular formula C11H18N4O and a molecular weight of 222.29 g/mol. Its IUPAC name is N-(1-amino-4-methylpentan-2-yl)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(1-amino-4-methylpentan-2-yl)pyrazine-2-carboxamide
PubChem CID63888138
Molecular FormulaC11H18N4O
Molecular Weight222.29 g/mol
Exact Mass222.15
IUPAC NameN-(1-amino-4-methylpentan-2-yl)pyrazine-2-carboxamide
SMILESCC(C)CC(CN)NC(=O)c1cnccn1
InChIInChI=1S/C11H18N4O/c1-8(2)5-9(6-12)15-11(16)10-7-13-3-4-14-10/h3-4,7-9H,5-6,12H2,1-2H3,(H,15,16)
InChIKeyPZBAJGCNWRQQKT-UHFFFAOYSA-N
XLogP0.58
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 50.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-[[(1R)-1-hydroxy-3-methylbutyl]amino]-2-oxoethyl]pyrazine-2-carboxamide
CID 144733404
ethane;N-propan-2-ylpyrazine-2-carboxamide
CID 143147775
N-[(2S)-1-amino-1-oxopropan-2-yl]pyrazine-2-carboxamide
CID 130166243
N-(2,4-dimethylpentan-3-yl)pyrazine-2-carboxamide
CID 20782723
N-(2-amino-1-cyclopropylethyl)pyrazine-2-carboxamide;dihydrochloride
CID 119616630
N-(1-amino-4-methylpentan-2-yl)-2-pyridin-4-yl-1,3-thiazole-5-carboxamide;dihydrochloride
CID 119585732
N-(1-amino-4-methylpentan-2-yl)-5-methyl-1,2-oxazole-3-carboxamide
CID 63888339
[(1R)-3-methyl-1-[[(2R)-3-methyl-2-(pyrazine-2-carbonylamino)butanoyl]amino]butyl]boronic acid
CID 74767136
4-methyl-2-N-pyrazin-2-ylpentane-1,2-diamine
CID 63759425
N-(1-amino-4-methylpentan-2-yl)-2-methylpyrazole-3-carboxamide
CID 63754352
N-[(2S)-4-methyl-1-oxo-1-[2-(pyridine-4-carbonyl)hydrazinyl]pentan-2-yl]pyrazine-2-carboxamide
CID 146575761
N-[(1S)-1-pyridin-4-ylethyl]pyrazine-2-carboxamide
CID 30479888

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-4-methylpentan-2-yl)pyrazine-2-carboxamide?
The IUPAC name of N-(1-amino-4-methylpentan-2-yl)pyrazine-2-carboxamide (CID 63888138) is N-(1-amino-4-methylpentan-2-yl)pyrazine-2-carboxamide.
What is the SMILES notation for N-(1-amino-4-methylpentan-2-yl)pyrazine-2-carboxamide?
The canonical SMILES for N-(1-amino-4-methylpentan-2-yl)pyrazine-2-carboxamide is CC(C)CC(CN)NC(=O)c1cnccn1.
What is the InChIKey of N-(1-amino-4-methylpentan-2-yl)pyrazine-2-carboxamide?
The InChIKey is PZBAJGCNWRQQKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O/c1-8(2)5-9(6-12)15-11(16)10-7-13-3-4-14-10/h3-4,7-9H,5-6,12H2,1-2H3,(H,15,16).
What are the key properties of N-(1-amino-4-methylpentan-2-yl)pyrazine-2-carboxamide?
N-(1-amino-4-methylpentan-2-yl)pyrazine-2-carboxamide has a molecular weight of 222.29 g/mol, XLogP of 0.58, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-4-methylpentan-2-yl)pyrazine-2-carboxamide is sourced from PubChem (CID 63888138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).