2-[2-(4-ethyl-3,5-dimethylpyrazol-1-yl)ethyl]-N-methylcyclopentan-1-amine

C15H27N3 — CID 79572278

IUPAC2-[2-(4-ethyl-3,5-dimethylpyrazol-1-yl)ethyl]-N-methylcyclopentan-1-amine
SMILESCCc1c(C)nn(CCC2CCCC2NC)c1C
InChIInChI=1S/C15H27N3/c1-5-14-11(2)17-18(12(14)3)10-9-13-7-6-8-15(13)16-4/h13,15-16H,5-10H2,1-4H3
InChIKeyFPZUVYVFZVJJGB-UHFFFAOYSA-N
MW249.40 g/mol
LogP2.84
Rot. Bonds5

About 2-[2-(4-ethyl-3,5-dimethylpyrazol-1-yl)ethyl]-N-methylcyclopentan-1-amine

2-[2-(4-ethyl-3,5-dimethylpyrazol-1-yl)ethyl]-N-methylcyclopentan-1-amine (PubChem CID 79572278) has the molecular formula C15H27N3 and a molecular weight of 249.40 g/mol. Its IUPAC name is 2-[2-(4-ethyl-3,5-dimethylpyrazol-1-yl)ethyl]-N-methylcyclopentan-1-amine.

Molecular Properties

Compound Name2-[2-(4-ethyl-3,5-dimethylpyrazol-1-yl)ethyl]-N-methylcyclopentan-1-amine
PubChem CID79572278
Molecular FormulaC15H27N3
Molecular Weight249.40 g/mol
Exact Mass249.22
IUPAC Name2-[2-(4-ethyl-3,5-dimethylpyrazol-1-yl)ethyl]-N-methylcyclopentan-1-amine
SMILESCCc1c(C)nn(CCC2CCCC2NC)c1C
InChIInChI=1S/C15H27N3/c1-5-14-11(2)17-18(12(14)3)10-9-13-7-6-8-15(13)16-4/h13,15-16H,5-10H2,1-4H3
InChIKeyFPZUVYVFZVJJGB-UHFFFAOYSA-N
XLogP2.84
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.40
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-methyl-3-[2-[2-(methylamino)cyclopentyl]ethyl]imidazolidine-2,4-dione
CID 79572752
N-[2-(4-ethyl-3,5-dimethylpyrazol-1-yl)ethyl]-3-methylcyclohexan-1-amine
CID 62567794
2-[2-(3,5-dimethyl-1,2,4-triazol-1-yl)ethyl]-N-ethylcyclopentan-1-amine
CID 79572173
5-(4-ethyl-3,5-dimethylpyrazol-1-yl)-2-methyl-2-(methylamino)pentan-1-ol
CID 64810713
2-[2-[2-(methylamino)cyclopentyl]ethyl]-[1,2,4]triazolo[4,3-a]pyrazin-3-one
CID 79573346
1-[5-[(4-ethyl-3,5-dimethylpyrazol-1-yl)methyl]oxolan-2-yl]-N-methylmethanamine
CID 62440987
N-[2-(4-ethyl-3,5-dimethylpyrazol-1-yl)ethyl]prop-2-en-1-amine
CID 62567598
2-[2-[2-(methylamino)cyclopentyl]ethyl]-5-[methyl(propyl)amino]pyridazin-3-one
CID 114395180
N-methyl-2-octylcyclohexan-1-amine
CID 63400173
2-[2-(2-ethylazepan-1-yl)ethyl]-N-methylcyclopentan-1-amine
CID 113441645
4-ethyl-3,5-dimethyl-1-(oxiran-2-ylmethyl)pyrazole
CID 61236679
5-(4-ethyl-3,5-dimethylpyrazol-1-yl)pentan-1-ol
CID 62229176

Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-ethyl-3,5-dimethylpyrazol-1-yl)ethyl]-N-methylcyclopentan-1-amine?
The IUPAC name of 2-[2-(4-ethyl-3,5-dimethylpyrazol-1-yl)ethyl]-N-methylcyclopentan-1-amine (CID 79572278) is 2-[2-(4-ethyl-3,5-dimethylpyrazol-1-yl)ethyl]-N-methylcyclopentan-1-amine.
What is the SMILES notation for 2-[2-(4-ethyl-3,5-dimethylpyrazol-1-yl)ethyl]-N-methylcyclopentan-1-amine?
The canonical SMILES for 2-[2-(4-ethyl-3,5-dimethylpyrazol-1-yl)ethyl]-N-methylcyclopentan-1-amine is CCc1c(C)nn(CCC2CCCC2NC)c1C.
What is the InChIKey of 2-[2-(4-ethyl-3,5-dimethylpyrazol-1-yl)ethyl]-N-methylcyclopentan-1-amine?
The InChIKey is FPZUVYVFZVJJGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3/c1-5-14-11(2)17-18(12(14)3)10-9-13-7-6-8-15(13)16-4/h13,15-16H,5-10H2,1-4H3.
What are the key properties of 2-[2-(4-ethyl-3,5-dimethylpyrazol-1-yl)ethyl]-N-methylcyclopentan-1-amine?
2-[2-(4-ethyl-3,5-dimethylpyrazol-1-yl)ethyl]-N-methylcyclopentan-1-amine has a molecular weight of 249.40 g/mol, XLogP of 2.84, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4-ethyl-3,5-dimethylpyrazol-1-yl)ethyl]-N-methylcyclopentan-1-amine is sourced from PubChem (CID 79572278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).