1-methyl-5-N-(3-methylcyclohexyl)-3-propylpyrazole-4,5-diamine

C14H26N4 — CID 66019813

IUPAC1-methyl-5-N-(3-methylcyclohexyl)-3-propylpyrazole-4,5-diamine
SMILESCCCc1nn(C)c(NC2CCCC(C)C2)c1N
InChIInChI=1S/C14H26N4/c1-4-6-12-13(15)14(18(3)17-12)16-11-8-5-7-10(2)9-11/h10-11,16H,4-9,15H2,1-3H3
InChIKeyUMNOCHUVLVPTDZ-UHFFFAOYSA-N
MW250.39 g/mol
LogP2.95
Rot. Bonds4

About 1-methyl-5-N-(3-methylcyclohexyl)-3-propylpyrazole-4,5-diamine

1-methyl-5-N-(3-methylcyclohexyl)-3-propylpyrazole-4,5-diamine (PubChem CID 66019813) has the molecular formula C14H26N4 and a molecular weight of 250.39 g/mol. Its IUPAC name is 1-methyl-5-N-(3-methylcyclohexyl)-3-propylpyrazole-4,5-diamine.

Molecular Properties

Compound Name1-methyl-5-N-(3-methylcyclohexyl)-3-propylpyrazole-4,5-diamine
PubChem CID66019813
Molecular FormulaC14H26N4
Molecular Weight250.39 g/mol
Exact Mass250.22
IUPAC Name1-methyl-5-N-(3-methylcyclohexyl)-3-propylpyrazole-4,5-diamine
SMILESCCCc1nn(C)c(NC2CCCC(C)C2)c1N
InChIInChI=1S/C14H26N4/c1-4-6-12-13(15)14(18(3)17-12)16-11-8-5-7-10(2)9-11/h10-11,16H,4-9,15H2,1-3H3
InChIKeyUMNOCHUVLVPTDZ-UHFFFAOYSA-N
XLogP2.95
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 1-methyl-5-N-(3-methylcyclohexyl)-3-propylpyrazole-4,5-diamine 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

5-N-cycloheptyl-1-methyl-3-propylpyrazole-4,5-diamine
CID 66017100
1-methyl-5-N-(oxan-3-yl)-3-propylpyrazole-4,5-diamine
CID 66017732
5-N-(1,1-dioxothiolan-3-yl)-1-methyl-3-propylpyrazole-4,5-diamine
CID 66018055
5-N,1-dimethyl-5-N-(3-methylcyclohexyl)-3-propylpyrazole-4,5-diamine
CID 66019252
1-methyl-3-propyl-5-N-(2,2,3,3-tetramethylcyclopropyl)pyrazole-4,5-diamine
CID 79353358
3-ethyl-1-methyl-5-N-(1-methylpiperidin-3-yl)pyrazole-4,5-diamine
CID 66014594
N-cyclobutyl-1-methyl-4-nitro-3-propylpyrazol-5-amine
CID 66017295
1,3-dimethyl-5-[(3-methylcyclohexyl)amino]pyrazole-4-carbothioamide
CID 63756865
5-methyl-4-N-(3-methylcyclohexyl)-2-propylpyrimidine-4,6-diamine
CID 80994131
5-N-(4,4-dimethylcyclohexyl)-3-ethyl-1-methylpyrazole-4,5-diamine
CID 66014444
5-N-(2,3-dimethylcyclohexyl)-3-ethyl-1-methylpyrazole-4,5-diamine
CID 66016356
5-N-(3-ethylcyclohexyl)-1-methyl-3-propan-2-ylpyrazole-4,5-diamine
CID 66012146

Frequently Asked Questions

What is the IUPAC name of 1-methyl-5-N-(3-methylcyclohexyl)-3-propylpyrazole-4,5-diamine?
The IUPAC name of 1-methyl-5-N-(3-methylcyclohexyl)-3-propylpyrazole-4,5-diamine (CID 66019813) is 1-methyl-5-N-(3-methylcyclohexyl)-3-propylpyrazole-4,5-diamine.
What is the SMILES notation for 1-methyl-5-N-(3-methylcyclohexyl)-3-propylpyrazole-4,5-diamine?
The canonical SMILES for 1-methyl-5-N-(3-methylcyclohexyl)-3-propylpyrazole-4,5-diamine is CCCc1nn(C)c(NC2CCCC(C)C2)c1N.
What is the InChIKey of 1-methyl-5-N-(3-methylcyclohexyl)-3-propylpyrazole-4,5-diamine?
The InChIKey is UMNOCHUVLVPTDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4/c1-4-6-12-13(15)14(18(3)17-12)16-11-8-5-7-10(2)9-11/h10-11,16H,4-9,15H2,1-3H3.
What are the key properties of 1-methyl-5-N-(3-methylcyclohexyl)-3-propylpyrazole-4,5-diamine?
1-methyl-5-N-(3-methylcyclohexyl)-3-propylpyrazole-4,5-diamine has a molecular weight of 250.39 g/mol, XLogP of 2.95, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-5-N-(3-methylcyclohexyl)-3-propylpyrazole-4,5-diamine is sourced from PubChem (CID 66019813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).