4-methyl-1-[(1-methylpyrazol-4-yl)methyl]cyclohexan-1-amine

C12H21N3 — CID 62126227

IUPAC4-methyl-1-[(1-methylpyrazol-4-yl)methyl]cyclohexan-1-amine
SMILESCC1CCC(N)(Cc2cnn(C)c2)CC1
InChIInChI=1S/C12H21N3/c1-10-3-5-12(13,6-4-10)7-11-8-14-15(2)9-11/h8-10H,3-7,13H2,1-2H3
InChIKeyCVZDEEOMKFSFKI-UHFFFAOYSA-N
MW207.32 g/mol
LogP1.87
Rot. Bonds2

About 4-methyl-1-[(1-methylpyrazol-4-yl)methyl]cyclohexan-1-amine

4-methyl-1-[(1-methylpyrazol-4-yl)methyl]cyclohexan-1-amine (PubChem CID 62126227) has the molecular formula C12H21N3 and a molecular weight of 207.32 g/mol. Its IUPAC name is 4-methyl-1-[(1-methylpyrazol-4-yl)methyl]cyclohexan-1-amine.

Molecular Properties

Compound Name4-methyl-1-[(1-methylpyrazol-4-yl)methyl]cyclohexan-1-amine
PubChem CID62126227
Molecular FormulaC12H21N3
Molecular Weight207.32 g/mol
Exact Mass207.17
IUPAC Name4-methyl-1-[(1-methylpyrazol-4-yl)methyl]cyclohexan-1-amine
SMILESCC1CCC(N)(Cc2cnn(C)c2)CC1
InChIInChI=1S/C12H21N3/c1-10-3-5-12(13,6-4-10)7-11-8-14-15(2)9-11/h8-10H,3-7,13H2,1-2H3
InChIKeyCVZDEEOMKFSFKI-UHFFFAOYSA-N
XLogP1.87
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-methyl-1-[(1-methylpyrazol-4-yl)methyl]cyclohexan-1-amine 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

3-methyl-1-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentan-1-amine
CID 103007104
4-methyl-1-[[(1-methylpyrazol-4-yl)methylamino]methyl]cyclohexan-1-ol
CID 65115613
2-methyl-1-[(1-methylpyrazol-4-yl)methyl]cyclohexan-1-amine
CID 62127317
3-methyl-1-[(1-methylpyrazol-4-yl)methyl]cyclopentane-1-carbonitrile
CID 65401861
1-(aminomethyl)-N-ethyl-4-methyl-N-[(1-methylpyrazol-4-yl)methyl]cyclohexan-1-amine
CID 62128099
1-(1-ethoxy-4-methylcyclohexyl)-2-(1-methylpyrazol-4-yl)ethanol
CID 116754734
N,N,3-trimethyl-1-[[(1-methylpyrazol-4-yl)methylamino]methyl]cyclohexan-1-amine
CID 61212484
1-[1-hydrazinyl-3-(1-methylpyrazol-4-yl)propyl]-N,N,4-trimethylcyclohexan-1-amine
CID 103026902
3-methyl-1-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentan-1-ol
CID 103006291
[2-methyl-3-[(1-methylpyrazol-4-yl)methyl]oxolan-3-yl]methanamine
CID 114534040
1-cyclopentyl-N-[(1-methylpyrazol-4-yl)methyl]methanamine
CID 43370784
N,N,4-trimethyl-1-[1-(methylamino)-3-(1-methylpyrazol-4-yl)propyl]cyclohexan-1-amine
CID 103011177

Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-[(1-methylpyrazol-4-yl)methyl]cyclohexan-1-amine?
The IUPAC name of 4-methyl-1-[(1-methylpyrazol-4-yl)methyl]cyclohexan-1-amine (CID 62126227) is 4-methyl-1-[(1-methylpyrazol-4-yl)methyl]cyclohexan-1-amine.
What is the SMILES notation for 4-methyl-1-[(1-methylpyrazol-4-yl)methyl]cyclohexan-1-amine?
The canonical SMILES for 4-methyl-1-[(1-methylpyrazol-4-yl)methyl]cyclohexan-1-amine is CC1CCC(N)(Cc2cnn(C)c2)CC1.
What is the InChIKey of 4-methyl-1-[(1-methylpyrazol-4-yl)methyl]cyclohexan-1-amine?
The InChIKey is CVZDEEOMKFSFKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3/c1-10-3-5-12(13,6-4-10)7-11-8-14-15(2)9-11/h8-10H,3-7,13H2,1-2H3.
What are the key properties of 4-methyl-1-[(1-methylpyrazol-4-yl)methyl]cyclohexan-1-amine?
4-methyl-1-[(1-methylpyrazol-4-yl)methyl]cyclohexan-1-amine has a molecular weight of 207.32 g/mol, XLogP of 1.87, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-[(1-methylpyrazol-4-yl)methyl]cyclohexan-1-amine is sourced from PubChem (CID 62126227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).