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

C15H27N3 — CID 64923128

IUPAC3-ethyl-N-[1-(1-ethylpyrazol-4-yl)ethyl]-2-methylcyclopentan-1-amine
SMILESCCC1CCC(NC(C)c2cnn(CC)c2)C1C
InChIInChI=1S/C15H27N3/c1-5-13-7-8-15(11(13)3)17-12(4)14-9-16-18(6-2)10-14/h9-13,15,17H,5-8H2,1-4H3
InChIKeyJMASQJHKHYRSHR-UHFFFAOYSA-N
MW249.40 g/mol
LogP3.38
Rot. Bonds5

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

3-ethyl-N-[1-(1-ethylpyrazol-4-yl)ethyl]-2-methylcyclopentan-1-amine (PubChem CID 64923128) has the molecular formula C15H27N3 and a molecular weight of 249.40 g/mol. Its IUPAC name is 3-ethyl-N-[1-(1-ethylpyrazol-4-yl)ethyl]-2-methylcyclopentan-1-amine.

Molecular Properties

Compound Name3-ethyl-N-[1-(1-ethylpyrazol-4-yl)ethyl]-2-methylcyclopentan-1-amine
PubChem CID64923128
Molecular FormulaC15H27N3
Molecular Weight249.40 g/mol
Exact Mass249.22
IUPAC Name3-ethyl-N-[1-(1-ethylpyrazol-4-yl)ethyl]-2-methylcyclopentan-1-amine
SMILESCCC1CCC(NC(C)c2cnn(CC)c2)C1C
InChIInChI=1S/C15H27N3/c1-5-13-7-8-15(11(13)3)17-12(4)14-9-16-18(6-2)10-14/h9-13,15,17H,5-8H2,1-4H3
InChIKeyJMASQJHKHYRSHR-UHFFFAOYSA-N
XLogP3.38
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 ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-cyclopropyl-N-[1-(1-ethylpyrazol-4-yl)ethyl]oxolan-3-amine
CID 113349326
3-ethyl-2-methyl-N-[1-(1-methylimidazol-2-yl)ethyl]cyclopentan-1-amine
CID 64923315
3-ethyl-2-methyl-N-[1-[4-(2-methylpropyl)phenyl]ethyl]cyclopentan-1-amine
CID 64922146
N-[1-(3-chlorophenyl)ethyl]-3-ethyl-2-methylcyclopentan-1-amine
CID 64921325
3-cyclopropyl-N-[1-(1-ethylpyrazol-4-yl)ethyl]propan-1-amine
CID 115890826
N-[1-(1-ethylpyrazol-4-yl)ethyl]-2,3-dihydro-1H-inden-2-amine
CID 104694884
3-ethyl-2-methyl-N-(1-pyridin-2-ylethyl)cyclopentan-1-amine
CID 64921322
2-[4-[1-[(3-ethyl-2-methylcyclopentyl)amino]ethyl]phenoxy]acetonitrile
CID 64923501
2,3-dimethyl-N-[1-(1-phenylpyrazol-4-yl)ethyl]cyclopentan-1-amine
CID 81473453
2-N-cyclopropyl-1-N-[1-(1-ethylpyrazol-4-yl)ethyl]-2-N-methylpropane-1,2-diamine
CID 113261232
N-[1-(2,4-dibromophenyl)ethyl]-3-ethyl-2-methylcyclopentan-1-amine
CID 64920776
3-ethyl-1-[1-(1-ethylpyrazol-4-yl)ethyl]piperidin-4-amine
CID 81457622

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N-[1-(1-ethylpyrazol-4-yl)ethyl]-2-methylcyclopentan-1-amine?
The IUPAC name of 3-ethyl-N-[1-(1-ethylpyrazol-4-yl)ethyl]-2-methylcyclopentan-1-amine (CID 64923128) is 3-ethyl-N-[1-(1-ethylpyrazol-4-yl)ethyl]-2-methylcyclopentan-1-amine.
What is the SMILES notation for 3-ethyl-N-[1-(1-ethylpyrazol-4-yl)ethyl]-2-methylcyclopentan-1-amine?
The canonical SMILES for 3-ethyl-N-[1-(1-ethylpyrazol-4-yl)ethyl]-2-methylcyclopentan-1-amine is CCC1CCC(NC(C)c2cnn(CC)c2)C1C.
What is the InChIKey of 3-ethyl-N-[1-(1-ethylpyrazol-4-yl)ethyl]-2-methylcyclopentan-1-amine?
The InChIKey is JMASQJHKHYRSHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3/c1-5-13-7-8-15(11(13)3)17-12(4)14-9-16-18(6-2)10-14/h9-13,15,17H,5-8H2,1-4H3.
What are the key properties of 3-ethyl-N-[1-(1-ethylpyrazol-4-yl)ethyl]-2-methylcyclopentan-1-amine?
3-ethyl-N-[1-(1-ethylpyrazol-4-yl)ethyl]-2-methylcyclopentan-1-amine has a molecular weight of 249.40 g/mol, XLogP of 3.38, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N-[1-(1-ethylpyrazol-4-yl)ethyl]-2-methylcyclopentan-1-amine is sourced from PubChem (CID 64923128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).