1-(2-pyridin-2-ylethyl)pyrazol-3-amine

C10H12N4 — CID 47002593

IUPAC1-(2-pyridin-2-ylethyl)pyrazol-3-amine
SMILESNc1ccn(CCc2ccccn2)n1
InChIInChI=1S/C10H12N4/c11-10-5-8-14(13-10)7-4-9-3-1-2-6-12-9/h1-3,5-6,8H,4,7H2,(H2,11,13)
InChIKeyFIHPZMCVXQPBTG-UHFFFAOYSA-N
MW188.23 g/mol
LogP1.10
Rot. Bonds3

About 1-(2-pyridin-2-ylethyl)pyrazol-3-amine

1-(2-pyridin-2-ylethyl)pyrazol-3-amine (PubChem CID 47002593) has the molecular formula C10H12N4 and a molecular weight of 188.23 g/mol. Its IUPAC name is 1-(2-pyridin-2-ylethyl)pyrazol-3-amine.

Molecular Properties

Compound Name1-(2-pyridin-2-ylethyl)pyrazol-3-amine
PubChem CID47002593
Molecular FormulaC10H12N4
Molecular Weight188.23 g/mol
Exact Mass188.11
IUPAC Name1-(2-pyridin-2-ylethyl)pyrazol-3-amine
SMILESNc1ccn(CCc2ccccn2)n1
InChIInChI=1S/C10H12N4/c11-10-5-8-14(13-10)7-4-9-3-1-2-6-12-9/h1-3,5-6,8H,4,7H2,(H2,11,13)
InChIKeyFIHPZMCVXQPBTG-UHFFFAOYSA-N
XLogP1.10
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(2-pyridin-2-ylethyl)pyrazol-3-amine?
The IUPAC name of 1-(2-pyridin-2-ylethyl)pyrazol-3-amine (CID 47002593) is 1-(2-pyridin-2-ylethyl)pyrazol-3-amine.
What is the SMILES notation for 1-(2-pyridin-2-ylethyl)pyrazol-3-amine?
The canonical SMILES for 1-(2-pyridin-2-ylethyl)pyrazol-3-amine is Nc1ccn(CCc2ccccn2)n1.
What is the InChIKey of 1-(2-pyridin-2-ylethyl)pyrazol-3-amine?
The InChIKey is FIHPZMCVXQPBTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4/c11-10-5-8-14(13-10)7-4-9-3-1-2-6-12-9/h1-3,5-6,8H,4,7H2,(H2,11,13).
What are the key properties of 1-(2-pyridin-2-ylethyl)pyrazol-3-amine?
1-(2-pyridin-2-ylethyl)pyrazol-3-amine has a molecular weight of 188.23 g/mol, XLogP of 1.10, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-pyridin-2-ylethyl)pyrazol-3-amine is sourced from PubChem (CID 47002593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).