3-methyl-1-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentan-1-amine

C12H21N3 — CID 103007104

IUPAC3-methyl-1-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentan-1-amine
SMILESCC1CCC(N)(CCc2cnn(C)c2)C1
InChIInChI=1S/C12H21N3/c1-10-3-5-12(13,7-10)6-4-11-8-14-15(2)9-11/h8-10H,3-7,13H2,1-2H3
InChIKeyLIZJUMPIUCXQDK-UHFFFAOYSA-N
MW207.32 g/mol
LogP1.87
Rot. Bonds3

About 3-methyl-1-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentan-1-amine

3-methyl-1-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentan-1-amine (PubChem CID 103007104) has the molecular formula C12H21N3 and a molecular weight of 207.32 g/mol. Its IUPAC name is 3-methyl-1-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentan-1-amine.

Molecular Properties

Compound Name3-methyl-1-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentan-1-amine
PubChem CID103007104
Molecular FormulaC12H21N3
Molecular Weight207.32 g/mol
Exact Mass207.17
IUPAC Name3-methyl-1-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentan-1-amine
SMILESCC1CCC(N)(CCc2cnn(C)c2)C1
InChIInChI=1S/C12H21N3/c1-10-3-5-12(13,7-10)6-4-11-8-14-15(2)9-11/h8-10H,3-7,13H2,1-2H3
InChIKeyLIZJUMPIUCXQDK-UHFFFAOYSA-N
XLogP1.87
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 ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-methyl-1-[(1-methylpyrazol-4-yl)methyl]cyclohexan-1-amine
CID 62126227
3-methyl-1-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentan-1-ol
CID 103006291
3-ethyl-1-[2-(1-methylpyrazol-4-yl)ethyl]cyclohexan-1-amine
CID 103007094
4-[2-(1-methylpyrazol-4-yl)ethyl]oxan-4-amine
CID 103007085
3-amino-1-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentan-1-ol
CID 103006526
1-[1-hydrazinyl-3-(1-methylpyrazol-4-yl)propyl]-N,N,4-trimethylcyclohexan-1-amine
CID 103026902
[4-tert-butyl-1-[2-(1-methylpyrazol-4-yl)ethyl]cyclohexyl]methanamine
CID 103014414
[3-[2-(1-methylpyrazol-4-yl)ethyl]-3-bicyclo[3.1.0]hexanyl]methanamine
CID 103014754
3-methyl-1-[(1-methylpyrazol-4-yl)methyl]cyclopentane-1-carbonitrile
CID 65401861
2,4,4-trimethyl-1-[2-(1-methylpyrazol-4-yl)ethyl]cyclohexan-1-ol
CID 103006543
N-[(1-amino-3-methylcyclohexyl)methyl]-1-methylpyrazol-4-amine
CID 103568920
1-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentan-1-ol
CID 103005734

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentan-1-amine?
The IUPAC name of 3-methyl-1-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentan-1-amine (CID 103007104) is 3-methyl-1-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentan-1-amine.
What is the SMILES notation for 3-methyl-1-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentan-1-amine?
The canonical SMILES for 3-methyl-1-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentan-1-amine is CC1CCC(N)(CCc2cnn(C)c2)C1.
What is the InChIKey of 3-methyl-1-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentan-1-amine?
The InChIKey is LIZJUMPIUCXQDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3/c1-10-3-5-12(13,7-10)6-4-11-8-14-15(2)9-11/h8-10H,3-7,13H2,1-2H3.
What are the key properties of 3-methyl-1-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentan-1-amine?
3-methyl-1-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentan-1-amine has a molecular weight of 207.32 g/mol, XLogP of 1.87, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentan-1-amine is sourced from PubChem (CID 103007104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).