N-[(1-cyclopentylpyrazol-4-yl)methyl]ethanamine

C11H19N3 — CID 61271729

IUPACN-[(1-cyclopentylpyrazol-4-yl)methyl]ethanamine
SMILESCCNCc1cnn(C2CCCC2)c1
InChIInChI=1S/C11H19N3/c1-2-12-7-10-8-13-14(9-10)11-5-3-4-6-11/h8-9,11-12H,2-7H2,1H3
InChIKeyDSCHOXNNYJJCGH-UHFFFAOYSA-N
MW193.29 g/mol
LogP2.11
Rot. Bonds4

About N-[(1-cyclopentylpyrazol-4-yl)methyl]ethanamine

N-[(1-cyclopentylpyrazol-4-yl)methyl]ethanamine (PubChem CID 61271729) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is N-[(1-cyclopentylpyrazol-4-yl)methyl]ethanamine.

Molecular Properties

Compound NameN-[(1-cyclopentylpyrazol-4-yl)methyl]ethanamine
PubChem CID61271729
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC NameN-[(1-cyclopentylpyrazol-4-yl)methyl]ethanamine
SMILESCCNCc1cnn(C2CCCC2)c1
InChIInChI=1S/C11H19N3/c1-2-12-7-10-8-13-14(9-10)11-5-3-4-6-11/h8-9,11-12H,2-7H2,1H3
InChIKeyDSCHOXNNYJJCGH-UHFFFAOYSA-N
XLogP2.11
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(1-cyclopentylpyrazol-4-yl)methyl]ethanamine?
The IUPAC name of N-[(1-cyclopentylpyrazol-4-yl)methyl]ethanamine (CID 61271729) is N-[(1-cyclopentylpyrazol-4-yl)methyl]ethanamine.
What is the SMILES notation for N-[(1-cyclopentylpyrazol-4-yl)methyl]ethanamine?
The canonical SMILES for N-[(1-cyclopentylpyrazol-4-yl)methyl]ethanamine is CCNCc1cnn(C2CCCC2)c1.
What is the InChIKey of N-[(1-cyclopentylpyrazol-4-yl)methyl]ethanamine?
The InChIKey is DSCHOXNNYJJCGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-2-12-7-10-8-13-14(9-10)11-5-3-4-6-11/h8-9,11-12H,2-7H2,1H3.
What are the key properties of N-[(1-cyclopentylpyrazol-4-yl)methyl]ethanamine?
N-[(1-cyclopentylpyrazol-4-yl)methyl]ethanamine has a molecular weight of 193.29 g/mol, XLogP of 2.11, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-cyclopentylpyrazol-4-yl)methyl]ethanamine is sourced from PubChem (CID 61271729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).