N-(2-methylpropyl)-2-[(2-oxo-1H-pyrazin-3-yl)amino]propanamide

C11H18N4O2 — CID 114569242

IUPACN-(2-methylpropyl)-2-[(2-oxo-1H-pyrazin-3-yl)amino]propanamide
SMILESCC(C)CNC(=O)C(C)Nc1ncc[nH]c1=O
InChIInChI=1S/C11H18N4O2/c1-7(2)6-14-10(16)8(3)15-9-11(17)13-5-4-12-9/h4-5,7-8H,6H2,1-3H3,(H,12,15)(H,13,17)(H,14,16)
InChIKeyWAXXPLHSHOOMEP-UHFFFAOYSA-N
MW238.29 g/mol
LogP0.34
Rot. Bonds5

About N-(2-methylpropyl)-2-[(2-oxo-1H-pyrazin-3-yl)amino]propanamide

N-(2-methylpropyl)-2-[(2-oxo-1H-pyrazin-3-yl)amino]propanamide (PubChem CID 114569242) has the molecular formula C11H18N4O2 and a molecular weight of 238.29 g/mol. Its IUPAC name is N-(2-methylpropyl)-2-[(2-oxo-1H-pyrazin-3-yl)amino]propanamide.

Molecular Properties

Compound NameN-(2-methylpropyl)-2-[(2-oxo-1H-pyrazin-3-yl)amino]propanamide
PubChem CID114569242
Molecular FormulaC11H18N4O2
Molecular Weight238.29 g/mol
Exact Mass238.14
IUPAC NameN-(2-methylpropyl)-2-[(2-oxo-1H-pyrazin-3-yl)amino]propanamide
SMILESCC(C)CNC(=O)C(C)Nc1ncc[nH]c1=O
InChIInChI=1S/C11H18N4O2/c1-7(2)6-14-10(16)8(3)15-9-11(17)13-5-4-12-9/h4-5,7-8H,6H2,1-3H3,(H,12,15)(H,13,17)(H,14,16)
InChIKeyWAXXPLHSHOOMEP-UHFFFAOYSA-N
XLogP0.34
TPSA86.88 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 50.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methylpropyl)-3-[(2-oxo-1H-pyrazin-3-yl)amino]propanamide
CID 114569295
N,N-dimethyl-2-[(2-oxo-1H-pyrazin-3-yl)amino]propanamide
CID 115898862
3-[[(2S)-1-hydroxy-3-methylbutan-2-yl]amino]-1H-pyrazin-2-one
CID 114986519
3-[(2-oxo-1H-pyrazin-3-yl)amino]butanamide
CID 115685000
3-methoxy-2-[(2-oxo-1H-pyrazin-3-yl)amino]propanoic acid
CID 114570562
methyl 3-hydroxy-2-[(2-oxo-1H-pyrazin-3-yl)amino]propanoate
CID 114571199
3-[(1-amino-4-methylpentan-2-yl)amino]-1H-pyrazin-2-one
CID 114570963
3-[(1-chloro-4-methylpentan-2-yl)amino]-1H-pyrazin-2-one
CID 114571361
2-[(6-amino-5-bromopyrimidin-4-yl)amino]-N-(2-methylpropyl)propanamide
CID 114072700
2-[(7-hydroxyisoquinolin-1-yl)amino]-N-(2-methylpropyl)propanamide
CID 106539409
2-[(2-oxo-1H-pyrazin-3-yl)amino]-N-propan-2-ylacetamide
CID 115650193
3-(4-aminopentan-2-ylamino)-1H-pyrazin-2-one
CID 114571495

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropyl)-2-[(2-oxo-1H-pyrazin-3-yl)amino]propanamide?
The IUPAC name of N-(2-methylpropyl)-2-[(2-oxo-1H-pyrazin-3-yl)amino]propanamide (CID 114569242) is N-(2-methylpropyl)-2-[(2-oxo-1H-pyrazin-3-yl)amino]propanamide.
What is the SMILES notation for N-(2-methylpropyl)-2-[(2-oxo-1H-pyrazin-3-yl)amino]propanamide?
The canonical SMILES for N-(2-methylpropyl)-2-[(2-oxo-1H-pyrazin-3-yl)amino]propanamide is CC(C)CNC(=O)C(C)Nc1ncc[nH]c1=O.
What is the InChIKey of N-(2-methylpropyl)-2-[(2-oxo-1H-pyrazin-3-yl)amino]propanamide?
The InChIKey is WAXXPLHSHOOMEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O2/c1-7(2)6-14-10(16)8(3)15-9-11(17)13-5-4-12-9/h4-5,7-8H,6H2,1-3H3,(H,12,15)(H,13,17)(H,14,16).
What are the key properties of N-(2-methylpropyl)-2-[(2-oxo-1H-pyrazin-3-yl)amino]propanamide?
N-(2-methylpropyl)-2-[(2-oxo-1H-pyrazin-3-yl)amino]propanamide has a molecular weight of 238.29 g/mol, XLogP of 0.34, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropyl)-2-[(2-oxo-1H-pyrazin-3-yl)amino]propanamide is sourced from PubChem (CID 114569242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).