3-[(1-ethylpyrazol-4-yl)methyl]-2-methylcyclopentan-1-amine

C12H21N3 — CID 64909188

IUPAC3-[(1-ethylpyrazol-4-yl)methyl]-2-methylcyclopentan-1-amine
SMILESCCn1cc(CC2CCC(N)C2C)cn1
InChIInChI=1S/C12H21N3/c1-3-15-8-10(7-14-15)6-11-4-5-12(13)9(11)2/h7-9,11-12H,3-6,13H2,1-2H3
InChIKeyXKEIVBMYLBPXDW-UHFFFAOYSA-N
MW207.32 g/mol
LogP1.82
Rot. Bonds3

About 3-[(1-ethylpyrazol-4-yl)methyl]-2-methylcyclopentan-1-amine

3-[(1-ethylpyrazol-4-yl)methyl]-2-methylcyclopentan-1-amine (PubChem CID 64909188) has the molecular formula C12H21N3 and a molecular weight of 207.32 g/mol. Its IUPAC name is 3-[(1-ethylpyrazol-4-yl)methyl]-2-methylcyclopentan-1-amine.

Molecular Properties

Compound Name3-[(1-ethylpyrazol-4-yl)methyl]-2-methylcyclopentan-1-amine
PubChem CID64909188
Molecular FormulaC12H21N3
Molecular Weight207.32 g/mol
Exact Mass207.17
IUPAC Name3-[(1-ethylpyrazol-4-yl)methyl]-2-methylcyclopentan-1-amine
SMILESCCn1cc(CC2CCC(N)C2C)cn1
InChIInChI=1S/C12H21N3/c1-3-15-8-10(7-14-15)6-11-4-5-12(13)9(11)2/h7-9,11-12H,3-6,13H2,1-2H3
InChIKeyXKEIVBMYLBPXDW-UHFFFAOYSA-N
XLogP1.82
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-[(1-ethylpyrazol-4-yl)methyl]-2-methylcyclopentan-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

[2-[(1-ethylpyrazol-4-yl)methyl]-4-methylcyclohexyl]methanamine
CID 81010305
4-[(1-ethylpyrazol-4-yl)methyl]cyclohexan-1-amine
CID 83261894
2-[(1-ethylpyrazol-4-yl)methyl]-4-propylcyclohexan-1-amine
CID 62128171
2-[(1-ethylpyrazol-4-yl)methyl]cyclopentan-1-ol
CID 62127889
N-[[2-[(1-ethylpyrazol-4-yl)methyl]-4-methylcyclohexyl]methyl]cyclopropanamine
CID 81032362
1-ethyl-4-(oxiran-2-ylmethyl)pyrazole
CID 115410523
N-ethyl-2-[(1-ethylpyrazol-4-yl)methyl]-4-methylcyclohexan-1-amine
CID 55041287
2-[(1-ethylpyrazol-4-yl)methyl]-N-methylcycloheptan-1-amine
CID 62126946
2-[(1-ethylpyrazol-4-yl)methyl]-4,4-dimethylcyclohexane-1-carboxylic acid
CID 81021094
3-[(1-ethylimidazol-2-yl)methyl]-2-methylcyclopentan-1-amine
CID 79762054
8-[(1-ethylpyrazol-4-yl)methyl]-8-azabicyclo[3.2.1]octan-3-amine
CID 62127131
2-methyl-3-(1-propylpyrazol-4-yl)cyclopentan-1-amine
CID 64908753

Frequently Asked Questions

What is the IUPAC name of 3-[(1-ethylpyrazol-4-yl)methyl]-2-methylcyclopentan-1-amine?
The IUPAC name of 3-[(1-ethylpyrazol-4-yl)methyl]-2-methylcyclopentan-1-amine (CID 64909188) is 3-[(1-ethylpyrazol-4-yl)methyl]-2-methylcyclopentan-1-amine.
What is the SMILES notation for 3-[(1-ethylpyrazol-4-yl)methyl]-2-methylcyclopentan-1-amine?
The canonical SMILES for 3-[(1-ethylpyrazol-4-yl)methyl]-2-methylcyclopentan-1-amine is CCn1cc(CC2CCC(N)C2C)cn1.
What is the InChIKey of 3-[(1-ethylpyrazol-4-yl)methyl]-2-methylcyclopentan-1-amine?
The InChIKey is XKEIVBMYLBPXDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3/c1-3-15-8-10(7-14-15)6-11-4-5-12(13)9(11)2/h7-9,11-12H,3-6,13H2,1-2H3.
What are the key properties of 3-[(1-ethylpyrazol-4-yl)methyl]-2-methylcyclopentan-1-amine?
3-[(1-ethylpyrazol-4-yl)methyl]-2-methylcyclopentan-1-amine has a molecular weight of 207.32 g/mol, XLogP of 1.82, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(1-ethylpyrazol-4-yl)methyl]-2-methylcyclopentan-1-amine is sourced from PubChem (CID 64909188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).