2-cyclopentyl-N-ethyl-1-(1-propylpyrazol-4-yl)ethanamine

C15H27N3 — CID 115807398

IUPAC2-cyclopentyl-N-ethyl-1-(1-propylpyrazol-4-yl)ethanamine
SMILESCCCn1cc(C(CC2CCCC2)NCC)cn1
InChIInChI=1S/C15H27N3/c1-3-9-18-12-14(11-17-18)15(16-4-2)10-13-7-5-6-8-13/h11-13,15-16H,3-10H2,1-2H3
InChIKeyDTGPWGVZJDZGDW-UHFFFAOYSA-N
MW249.40 g/mol
LogP3.52
Rot. Bonds7

About 2-cyclopentyl-N-ethyl-1-(1-propylpyrazol-4-yl)ethanamine

2-cyclopentyl-N-ethyl-1-(1-propylpyrazol-4-yl)ethanamine (PubChem CID 115807398) has the molecular formula C15H27N3 and a molecular weight of 249.40 g/mol. Its IUPAC name is 2-cyclopentyl-N-ethyl-1-(1-propylpyrazol-4-yl)ethanamine.

Molecular Properties

Compound Name2-cyclopentyl-N-ethyl-1-(1-propylpyrazol-4-yl)ethanamine
PubChem CID115807398
Molecular FormulaC15H27N3
Molecular Weight249.40 g/mol
Exact Mass249.22
IUPAC Name2-cyclopentyl-N-ethyl-1-(1-propylpyrazol-4-yl)ethanamine
SMILESCCCn1cc(C(CC2CCCC2)NCC)cn1
InChIInChI=1S/C15H27N3/c1-3-9-18-12-14(11-17-18)15(16-4-2)10-13-7-5-6-8-13/h11-13,15-16H,3-10H2,1-2H3
InChIKeyDTGPWGVZJDZGDW-UHFFFAOYSA-N
XLogP3.52
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.40
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[1-(2-cyclopentylethyl)pyrazol-4-yl]-N-ethylpropan-1-amine
CID 114192598
[1-(1-propylpyrazol-4-yl)-2-(thian-4-yl)ethyl]hydrazine
CID 105288638
2-cyclobutyl-1-(1-ethylpyrazol-4-yl)-N-methylethanamine
CID 103168314
N-ethyl-1-(1-methylpyrazol-4-yl)-2-(oxan-4-yl)ethanamine
CID 65195339
2-cyclohexyl-N-methyl-1-(1-methylpyrazol-4-yl)ethanamine
CID 43485883
2-cyclobutyl-N-ethyl-1-(1-phenylpyrazol-4-yl)ethanamine
CID 105151678
1-cyclooctyl-N-methyl-1-(1-propylpyrazol-4-yl)methanamine
CID 80603467
cycloheptyl-(1-propylpyrazol-4-yl)methanol
CID 65398920
N-(1-cyclobutylpropan-2-yl)-1-propylpyrazol-4-amine
CID 115921376
1-[1-(cyclopentylmethyl)pyrazol-4-yl]-N-propylpropan-1-amine
CID 62730353
2-cyclohexyl-N-ethyl-1-(4-methoxy-1-propylpyrazol-5-yl)ethanamine
CID 105048780
N-[2-(2-bicyclo[2.2.1]heptanyl)-1-(1-propylpyrazol-4-yl)ethyl]propan-1-amine
CID 115807952

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-N-ethyl-1-(1-propylpyrazol-4-yl)ethanamine?
The IUPAC name of 2-cyclopentyl-N-ethyl-1-(1-propylpyrazol-4-yl)ethanamine (CID 115807398) is 2-cyclopentyl-N-ethyl-1-(1-propylpyrazol-4-yl)ethanamine.
What is the SMILES notation for 2-cyclopentyl-N-ethyl-1-(1-propylpyrazol-4-yl)ethanamine?
The canonical SMILES for 2-cyclopentyl-N-ethyl-1-(1-propylpyrazol-4-yl)ethanamine is CCCn1cc(C(CC2CCCC2)NCC)cn1.
What is the InChIKey of 2-cyclopentyl-N-ethyl-1-(1-propylpyrazol-4-yl)ethanamine?
The InChIKey is DTGPWGVZJDZGDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3/c1-3-9-18-12-14(11-17-18)15(16-4-2)10-13-7-5-6-8-13/h11-13,15-16H,3-10H2,1-2H3.
What are the key properties of 2-cyclopentyl-N-ethyl-1-(1-propylpyrazol-4-yl)ethanamine?
2-cyclopentyl-N-ethyl-1-(1-propylpyrazol-4-yl)ethanamine has a molecular weight of 249.40 g/mol, XLogP of 3.52, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-N-ethyl-1-(1-propylpyrazol-4-yl)ethanamine is sourced from PubChem (CID 115807398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).