4-methyl-1-(pyridin-3-ylmethyl)pyrazol-5-amine

C10H12N4 — CID 1096900

IUPAC4-methyl-1-(pyridin-3-ylmethyl)pyrazol-5-amine
SMILESCc1cnn(Cc2cccnc2)c1N
InChIInChI=1S/C10H12N4/c1-8-5-13-14(10(8)11)7-9-3-2-4-12-6-9/h2-6H,7,11H2,1H3
InChIKeyUBOZLFNLKPCNIT-UHFFFAOYSA-N
MW188.23 g/mol
LogP1.22
Rot. Bonds2

About 4-methyl-1-(pyridin-3-ylmethyl)pyrazol-5-amine

4-methyl-1-(pyridin-3-ylmethyl)pyrazol-5-amine (PubChem CID 1096900) has the molecular formula C10H12N4 and a molecular weight of 188.23 g/mol. Its IUPAC name is 4-methyl-1-(pyridin-3-ylmethyl)pyrazol-5-amine.

Molecular Properties

Compound Name4-methyl-1-(pyridin-3-ylmethyl)pyrazol-5-amine
PubChem CID1096900
Molecular FormulaC10H12N4
Molecular Weight188.23 g/mol
Exact Mass188.11
IUPAC Name4-methyl-1-(pyridin-3-ylmethyl)pyrazol-5-amine
SMILESCc1cnn(Cc2cccnc2)c1N
InChIInChI=1S/C10H12N4/c1-8-5-13-14(10(8)11)7-9-3-2-4-12-6-9/h2-6H,7,11H2,1H3
InChIKeyUBOZLFNLKPCNIT-UHFFFAOYSA-N
XLogP1.22
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-(pyridin-3-ylmethyl)pyrazol-5-amine?
The IUPAC name of 4-methyl-1-(pyridin-3-ylmethyl)pyrazol-5-amine (CID 1096900) is 4-methyl-1-(pyridin-3-ylmethyl)pyrazol-5-amine.
What is the SMILES notation for 4-methyl-1-(pyridin-3-ylmethyl)pyrazol-5-amine?
The canonical SMILES for 4-methyl-1-(pyridin-3-ylmethyl)pyrazol-5-amine is Cc1cnn(Cc2cccnc2)c1N.
What is the InChIKey of 4-methyl-1-(pyridin-3-ylmethyl)pyrazol-5-amine?
The InChIKey is UBOZLFNLKPCNIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4/c1-8-5-13-14(10(8)11)7-9-3-2-4-12-6-9/h2-6H,7,11H2,1H3.
What are the key properties of 4-methyl-1-(pyridin-3-ylmethyl)pyrazol-5-amine?
4-methyl-1-(pyridin-3-ylmethyl)pyrazol-5-amine has a molecular weight of 188.23 g/mol, XLogP of 1.22, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-(pyridin-3-ylmethyl)pyrazol-5-amine is sourced from PubChem (CID 1096900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).