2-amino-4-methyl-N-(1,3,5-trimethylpyrazol-4-yl)pentanamide

C12H22N4O — CID 61252272

IUPAC2-amino-4-methyl-N-(1,3,5-trimethylpyrazol-4-yl)pentanamide
SMILESCc1nn(C)c(C)c1NC(=O)C(N)CC(C)C
InChIInChI=1S/C12H22N4O/c1-7(2)6-10(13)12(17)14-11-8(3)15-16(5)9(11)4/h7,10H,6,13H2,1-5H3,(H,14,17)
InChIKeyKRXFZKUMUGRKPQ-UHFFFAOYSA-N
MW238.33 g/mol
LogP1.35
Rot. Bonds4

About 2-amino-4-methyl-N-(1,3,5-trimethylpyrazol-4-yl)pentanamide

2-amino-4-methyl-N-(1,3,5-trimethylpyrazol-4-yl)pentanamide (PubChem CID 61252272) has the molecular formula C12H22N4O and a molecular weight of 238.33 g/mol. Its IUPAC name is 2-amino-4-methyl-N-(1,3,5-trimethylpyrazol-4-yl)pentanamide.

Molecular Properties

Compound Name2-amino-4-methyl-N-(1,3,5-trimethylpyrazol-4-yl)pentanamide
PubChem CID61252272
Molecular FormulaC12H22N4O
Molecular Weight238.33 g/mol
Exact Mass238.18
IUPAC Name2-amino-4-methyl-N-(1,3,5-trimethylpyrazol-4-yl)pentanamide
SMILESCc1nn(C)c(C)c1NC(=O)C(N)CC(C)C
InChIInChI=1S/C12H22N4O/c1-7(2)6-10(13)12(17)14-11-8(3)15-16(5)9(11)4/h7,10H,6,13H2,1-5H3,(H,14,17)
InChIKeyKRXFZKUMUGRKPQ-UHFFFAOYSA-N
XLogP1.35
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-amino-4-methyl-N-(1,3,5-trimethylpyrazol-4-yl)pentanamide 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

2-amino-3-phenyl-N-(1,3,5-trimethylpyrazol-4-yl)propanamide
CID 61252081
(2S)-2-amino-N-(2,5-dimethylpyrazol-3-yl)-4-methylpentanamide;hydrochloride
CID 119680179
(2S)-2-amino-N-(1,3-dimethylpyrazol-4-yl)-4-methylpentanamide
CID 103811522
3-amino-4-[(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)amino]-4-oxobutanoic acid
CID 64895716
(2S)-2-amino-4-methyl-N-(2,3,4,5,6-pentafluorophenyl)pentanamide
CID 115564487
2-amino-3-[2-oxo-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl]sulfanylpropanoic acid
CID 43385512
4-hydroxy-N-(1,3,5-trimethylpyrazol-4-yl)pentanamide
CID 79192900
2-amino-N-(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)pentanamide
CID 54863652
(2R)-2-amino-N-(2,6-dibromo-4-methylphenyl)-4-methylpentanamide
CID 28991563
2-methylsulfanyl-N-(1,3,5-trimethylpyrazol-4-yl)acetamide
CID 47006977
(2R)-2-[[2-oxo-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl]amino]propanoic acid
CID 83193828
3-N-(1,3,5-trimethylpyrazol-4-yl)butane-2,3-diamine
CID 130573982

Frequently Asked Questions

What is the IUPAC name of 2-amino-4-methyl-N-(1,3,5-trimethylpyrazol-4-yl)pentanamide?
The IUPAC name of 2-amino-4-methyl-N-(1,3,5-trimethylpyrazol-4-yl)pentanamide (CID 61252272) is 2-amino-4-methyl-N-(1,3,5-trimethylpyrazol-4-yl)pentanamide.
What is the SMILES notation for 2-amino-4-methyl-N-(1,3,5-trimethylpyrazol-4-yl)pentanamide?
The canonical SMILES for 2-amino-4-methyl-N-(1,3,5-trimethylpyrazol-4-yl)pentanamide is Cc1nn(C)c(C)c1NC(=O)C(N)CC(C)C.
What is the InChIKey of 2-amino-4-methyl-N-(1,3,5-trimethylpyrazol-4-yl)pentanamide?
The InChIKey is KRXFZKUMUGRKPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4O/c1-7(2)6-10(13)12(17)14-11-8(3)15-16(5)9(11)4/h7,10H,6,13H2,1-5H3,(H,14,17).
What are the key properties of 2-amino-4-methyl-N-(1,3,5-trimethylpyrazol-4-yl)pentanamide?
2-amino-4-methyl-N-(1,3,5-trimethylpyrazol-4-yl)pentanamide has a molecular weight of 238.33 g/mol, XLogP of 1.35, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-methyl-N-(1,3,5-trimethylpyrazol-4-yl)pentanamide is sourced from PubChem (CID 61252272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).