1-cyclopentyl-N-[2-(1-methylpyrazol-3-yl)ethyl]ethanamine

C13H23N3 — CID 104629165

IUPAC1-cyclopentyl-N-[2-(1-methylpyrazol-3-yl)ethyl]ethanamine
SMILESCC(NCCc1ccn(C)n1)C1CCCC1
InChIInChI=1S/C13H23N3/c1-11(12-5-3-4-6-12)14-9-7-13-8-10-16(2)15-13/h8,10-12,14H,3-7,9H2,1-2H3
InChIKeyIXIZUFBCLWVUOU-UHFFFAOYSA-N
MW221.35 g/mol
LogP2.13
Rot. Bonds5

About 1-cyclopentyl-N-[2-(1-methylpyrazol-3-yl)ethyl]ethanamine

1-cyclopentyl-N-[2-(1-methylpyrazol-3-yl)ethyl]ethanamine (PubChem CID 104629165) has the molecular formula C13H23N3 and a molecular weight of 221.35 g/mol. Its IUPAC name is 1-cyclopentyl-N-[2-(1-methylpyrazol-3-yl)ethyl]ethanamine.

Molecular Properties

Compound Name1-cyclopentyl-N-[2-(1-methylpyrazol-3-yl)ethyl]ethanamine
PubChem CID104629165
Molecular FormulaC13H23N3
Molecular Weight221.35 g/mol
Exact Mass221.19
IUPAC Name1-cyclopentyl-N-[2-(1-methylpyrazol-3-yl)ethyl]ethanamine
SMILESCC(NCCc1ccn(C)n1)C1CCCC1
InChIInChI=1S/C13H23N3/c1-11(12-5-3-4-6-12)14-9-7-13-8-10-16(2)15-13/h8,10-12,14H,3-7,9H2,1-2H3
InChIKeyIXIZUFBCLWVUOU-UHFFFAOYSA-N
XLogP2.13
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.35
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(1-methylcyclopropyl)-N-[2-(1-methylpyrazol-3-yl)ethyl]ethanamine
CID 104629143
N-[2-(1-methylpyrazol-3-yl)ethyl]-2-propan-2-ylcyclohexan-1-amine
CID 113434855
1-(1-methylpiperidin-3-yl)-N-[(1-methylpyrazol-3-yl)methyl]ethanamine
CID 82881755
(1R)-1-cyclohexyl-N-(2-pyridin-2-ylethyl)ethanamine
CID 15206944
1-cyclohexyl-N-(2-pyridin-2-ylethyl)ethanamine
CID 15206943
N-[2-(1-methylpyrazol-3-yl)ethyl]-1-methylsulfonylpropan-2-amine
CID 104629114
1-cyclohexyl-N-[(1-methylpyrazol-3-yl)methyl]propan-1-amine
CID 78921262
N-[2-(1-methylpyrazol-3-yl)ethyl]-1-(1H-pyrazol-5-yl)ethanamine
CID 106104199
N-[1-[1-[(1-methylpyrazol-3-yl)methyl]piperidin-2-yl]ethyl]propan-1-amine
CID 82865657
1-cyclooctyl-2-(1-methylpyrazol-3-yl)ethanamine
CID 82876973
[1-cyclohexyl-2-(1-methylpyrazol-3-yl)ethyl]hydrazine
CID 105201792
1-(furan-2-yl)-N-[2-(1-methylpyrazol-3-yl)ethyl]ethanamine
CID 104629058

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-N-[2-(1-methylpyrazol-3-yl)ethyl]ethanamine?
The IUPAC name of 1-cyclopentyl-N-[2-(1-methylpyrazol-3-yl)ethyl]ethanamine (CID 104629165) is 1-cyclopentyl-N-[2-(1-methylpyrazol-3-yl)ethyl]ethanamine.
What is the SMILES notation for 1-cyclopentyl-N-[2-(1-methylpyrazol-3-yl)ethyl]ethanamine?
The canonical SMILES for 1-cyclopentyl-N-[2-(1-methylpyrazol-3-yl)ethyl]ethanamine is CC(NCCc1ccn(C)n1)C1CCCC1.
What is the InChIKey of 1-cyclopentyl-N-[2-(1-methylpyrazol-3-yl)ethyl]ethanamine?
The InChIKey is IXIZUFBCLWVUOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3/c1-11(12-5-3-4-6-12)14-9-7-13-8-10-16(2)15-13/h8,10-12,14H,3-7,9H2,1-2H3.
What are the key properties of 1-cyclopentyl-N-[2-(1-methylpyrazol-3-yl)ethyl]ethanamine?
1-cyclopentyl-N-[2-(1-methylpyrazol-3-yl)ethyl]ethanamine has a molecular weight of 221.35 g/mol, XLogP of 2.13, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-N-[2-(1-methylpyrazol-3-yl)ethyl]ethanamine is sourced from PubChem (CID 104629165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).