N-(4-amino-1,3-dimethylpyrazol-5-yl)-3-methylpentanamide

C11H20N4O — CID 114873543

IUPACN-(4-amino-1,3-dimethylpyrazol-5-yl)-3-methylpentanamide
SMILESCCC(C)CC(=O)Nc1c(N)c(C)nn1C
InChIInChI=1S/C11H20N4O/c1-5-7(2)6-9(16)13-11-10(12)8(3)14-15(11)4/h7H,5-6,12H2,1-4H3,(H,13,16)
InChIKeyHZNHVCJTBWILLW-UHFFFAOYSA-N
MW224.31 g/mol
LogP1.69
Rot. Bonds4

About N-(4-amino-1,3-dimethylpyrazol-5-yl)-3-methylpentanamide

N-(4-amino-1,3-dimethylpyrazol-5-yl)-3-methylpentanamide (PubChem CID 114873543) has the molecular formula C11H20N4O and a molecular weight of 224.31 g/mol. Its IUPAC name is N-(4-amino-1,3-dimethylpyrazol-5-yl)-3-methylpentanamide.

Molecular Properties

Compound NameN-(4-amino-1,3-dimethylpyrazol-5-yl)-3-methylpentanamide
PubChem CID114873543
Molecular FormulaC11H20N4O
Molecular Weight224.31 g/mol
Exact Mass224.16
IUPAC NameN-(4-amino-1,3-dimethylpyrazol-5-yl)-3-methylpentanamide
SMILESCCC(C)CC(=O)Nc1c(N)c(C)nn1C
InChIInChI=1S/C11H20N4O/c1-5-7(2)6-9(16)13-11-10(12)8(3)14-15(11)4/h7H,5-6,12H2,1-4H3,(H,13,16)
InChIKeyHZNHVCJTBWILLW-UHFFFAOYSA-N
XLogP1.69
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.31
LogP ≤ 51.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[1,3-dimethyl-5-(4-methyl-1,4-diazepan-1-yl)pyrazol-4-yl]methyl]-4-methylpentanamide
CID 53540973
N-[[1,3-dimethyl-5-(4-methyl-1,4-diazepan-1-yl)pyrazol-4-yl]methyl]-2-ethylbutanamide
CID 53542503
N-(1,3-dimethyl-5-piperazin-1-ylpyrazol-4-yl)cyclobutanecarboxamide
CID 172434420
N-(1,3-dimethyl-5-piperazin-1-ylpyrazol-4-yl)butanamide
CID 172436165
1-Acetyl-2(1,3,4-trimethyl-5-pyrazolyl) amino-2-imidazoline
CID 12763792
N-(4-amino-1,3-dimethylpyrazol-5-yl)-4,4,4-trifluorobutanamide
CID 80359885
N-(4-amino-1,3-dimethylpyrazol-5-yl)-3,3,3-trifluoropropanamide
CID 80360597
N-(4-amino-1,3-dimethylpyrazol-5-yl)-4,4-difluorocyclohexane-1-carboxamide
CID 81930503
N-(4-amino-1,3-dimethylpyrazol-5-yl)-4-(trifluoromethyl)cyclohexane-1-carboxamide
CID 81930817
N-(4-amino-1,3-dimethylpyrazol-5-yl)-3-(trifluoromethyl)cyclohexane-1-carboxamide
CID 81930818
N-(4-amino-1,3-dimethylpyrazol-5-yl)-3,3,3-trifluoro-2-(trifluoromethyl)propanamide
CID 103309074
N-(4-amino-1,3-dimethylpyrazol-5-yl)-2-(trifluoromethyl)cyclohexane-1-carboxamide
CID 104621929

Frequently Asked Questions

What is the IUPAC name of N-(4-amino-1,3-dimethylpyrazol-5-yl)-3-methylpentanamide?
The IUPAC name of N-(4-amino-1,3-dimethylpyrazol-5-yl)-3-methylpentanamide (CID 114873543) is N-(4-amino-1,3-dimethylpyrazol-5-yl)-3-methylpentanamide.
What is the SMILES notation for N-(4-amino-1,3-dimethylpyrazol-5-yl)-3-methylpentanamide?
The canonical SMILES for N-(4-amino-1,3-dimethylpyrazol-5-yl)-3-methylpentanamide is CCC(C)CC(=O)Nc1c(N)c(C)nn1C.
What is the InChIKey of N-(4-amino-1,3-dimethylpyrazol-5-yl)-3-methylpentanamide?
The InChIKey is HZNHVCJTBWILLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O/c1-5-7(2)6-9(16)13-11-10(12)8(3)14-15(11)4/h7H,5-6,12H2,1-4H3,(H,13,16).
What are the key properties of N-(4-amino-1,3-dimethylpyrazol-5-yl)-3-methylpentanamide?
N-(4-amino-1,3-dimethylpyrazol-5-yl)-3-methylpentanamide has a molecular weight of 224.31 g/mol, XLogP of 1.69, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-amino-1,3-dimethylpyrazol-5-yl)-3-methylpentanamide is sourced from PubChem (CID 114873543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).