N-(2-methylbutan-2-yl)-2-[(1-methylpyrazol-4-yl)amino]propanamide

C12H22N4O — CID 79779147

IUPACN-(2-methylbutan-2-yl)-2-[(1-methylpyrazol-4-yl)amino]propanamide
SMILESCCC(C)(C)NC(=O)C(C)Nc1cnn(C)c1
InChIInChI=1S/C12H22N4O/c1-6-12(3,4)15-11(17)9(2)14-10-7-13-16(5)8-10/h7-9,14H,6H2,1-5H3,(H,15,17)
InChIKeyVVSRPGMWMKRQDD-UHFFFAOYSA-N
MW238.33 g/mol
LogP1.53
Rot. Bonds5

About N-(2-methylbutan-2-yl)-2-[(1-methylpyrazol-4-yl)amino]propanamide

N-(2-methylbutan-2-yl)-2-[(1-methylpyrazol-4-yl)amino]propanamide (PubChem CID 79779147) has the molecular formula C12H22N4O and a molecular weight of 238.33 g/mol. Its IUPAC name is N-(2-methylbutan-2-yl)-2-[(1-methylpyrazol-4-yl)amino]propanamide.

Molecular Properties

Compound NameN-(2-methylbutan-2-yl)-2-[(1-methylpyrazol-4-yl)amino]propanamide
PubChem CID79779147
Molecular FormulaC12H22N4O
Molecular Weight238.33 g/mol
Exact Mass238.18
IUPAC NameN-(2-methylbutan-2-yl)-2-[(1-methylpyrazol-4-yl)amino]propanamide
SMILESCCC(C)(C)NC(=O)C(C)Nc1cnn(C)c1
InChIInChI=1S/C12H22N4O/c1-6-12(3,4)15-11(17)9(2)14-10-7-13-16(5)8-10/h7-9,14H,6H2,1-5H3,(H,15,17)
InChIKeyVVSRPGMWMKRQDD-UHFFFAOYSA-N
XLogP1.53
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(2-methylbutan-2-yl)-2-[(1-methylpyrazol-4-yl)amino]propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-carbamoyl-2-[(1-methylpyrazol-4-yl)amino]propanamide
CID 79778444
2-(3,4-dimethylanilino)-N-(2-methylbutan-2-yl)propanamide
CID 43112841
4-[[1-(2-methylbutan-2-ylamino)-1-oxopropan-2-yl]amino]benzamide
CID 43112980
N-tert-butyl-2-[[1-(2,2-difluoroethyl)pyrazol-4-yl]amino]propanamide
CID 86791911
3,3-dimethyl-2-[(1-methylpyrazol-4-yl)amino]butanoic acid
CID 127020438
2-[(1-methylpyrazol-4-yl)amino]-1-piperidin-1-ylpropan-1-one
CID 79769934
methyl 2-methyl-3-[(1-methylpyrazol-4-yl)amino]butanoate
CID 79778645
(2R)-N-(3-chlorophenyl)-2-[(1-methylpyrazol-4-yl)amino]propanamide
CID 97347601
2-butyl-N-(1-methylpyrazol-4-yl)hexanamide
CID 139359487
ethane;2-methyl-N-(1-methylpyrazol-4-yl)propanamide
CID 178157560
1-methyl-N-propan-2-ylpyrazol-4-amine;hydrochloride
CID 155858284
N-(5-fluoro-2-methylphenyl)-2-[(1-methylpyrazol-4-yl)amino]propanamide
CID 75507032

Frequently Asked Questions

What is the IUPAC name of N-(2-methylbutan-2-yl)-2-[(1-methylpyrazol-4-yl)amino]propanamide?
The IUPAC name of N-(2-methylbutan-2-yl)-2-[(1-methylpyrazol-4-yl)amino]propanamide (CID 79779147) is N-(2-methylbutan-2-yl)-2-[(1-methylpyrazol-4-yl)amino]propanamide.
What is the SMILES notation for N-(2-methylbutan-2-yl)-2-[(1-methylpyrazol-4-yl)amino]propanamide?
The canonical SMILES for N-(2-methylbutan-2-yl)-2-[(1-methylpyrazol-4-yl)amino]propanamide is CCC(C)(C)NC(=O)C(C)Nc1cnn(C)c1.
What is the InChIKey of N-(2-methylbutan-2-yl)-2-[(1-methylpyrazol-4-yl)amino]propanamide?
The InChIKey is VVSRPGMWMKRQDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4O/c1-6-12(3,4)15-11(17)9(2)14-10-7-13-16(5)8-10/h7-9,14H,6H2,1-5H3,(H,15,17).
What are the key properties of N-(2-methylbutan-2-yl)-2-[(1-methylpyrazol-4-yl)amino]propanamide?
N-(2-methylbutan-2-yl)-2-[(1-methylpyrazol-4-yl)amino]propanamide has a molecular weight of 238.33 g/mol, XLogP of 1.53, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylbutan-2-yl)-2-[(1-methylpyrazol-4-yl)amino]propanamide is sourced from PubChem (CID 79779147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).