2-(3-cyclopropylpyrazol-1-yl)-4-methylpyridine

C12H13N3 — CID 59448030

IUPAC2-(3-cyclopropylpyrazol-1-yl)-4-methylpyridine
SMILESCc1ccnc(-n2ccc(C3CC3)n2)c1
InChIInChI=1S/C12H13N3/c1-9-4-6-13-12(8-9)15-7-5-11(14-15)10-2-3-10/h4-8,10H,2-3H2,1H3
InChIKeyNFSXRPZCRAOENP-UHFFFAOYSA-N
MW199.26 g/mol
LogP2.45
Rot. Bonds2

About 2-(3-cyclopropylpyrazol-1-yl)-4-methylpyridine

2-(3-cyclopropylpyrazol-1-yl)-4-methylpyridine (PubChem CID 59448030) has the molecular formula C12H13N3 and a molecular weight of 199.26 g/mol. Its IUPAC name is 2-(3-cyclopropylpyrazol-1-yl)-4-methylpyridine.

Molecular Properties

Compound Name2-(3-cyclopropylpyrazol-1-yl)-4-methylpyridine
PubChem CID59448030
Molecular FormulaC12H13N3
Molecular Weight199.26 g/mol
Exact Mass199.11
IUPAC Name2-(3-cyclopropylpyrazol-1-yl)-4-methylpyridine
SMILESCc1ccnc(-n2ccc(C3CC3)n2)c1
InChIInChI=1S/C12H13N3/c1-9-4-6-13-12(8-9)15-7-5-11(14-15)10-2-3-10/h4-8,10H,2-3H2,1H3
InChIKeyNFSXRPZCRAOENP-UHFFFAOYSA-N
XLogP2.45
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.26
LogP ≤ 52.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3-cyclopropylpyrazol-1-yl)-4-methylpyridine?
The IUPAC name of 2-(3-cyclopropylpyrazol-1-yl)-4-methylpyridine (CID 59448030) is 2-(3-cyclopropylpyrazol-1-yl)-4-methylpyridine.
What is the SMILES notation for 2-(3-cyclopropylpyrazol-1-yl)-4-methylpyridine?
The canonical SMILES for 2-(3-cyclopropylpyrazol-1-yl)-4-methylpyridine is Cc1ccnc(-n2ccc(C3CC3)n2)c1.
What is the InChIKey of 2-(3-cyclopropylpyrazol-1-yl)-4-methylpyridine?
The InChIKey is NFSXRPZCRAOENP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3/c1-9-4-6-13-12(8-9)15-7-5-11(14-15)10-2-3-10/h4-8,10H,2-3H2,1H3.
What are the key properties of 2-(3-cyclopropylpyrazol-1-yl)-4-methylpyridine?
2-(3-cyclopropylpyrazol-1-yl)-4-methylpyridine has a molecular weight of 199.26 g/mol, XLogP of 2.45, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-cyclopropylpyrazol-1-yl)-4-methylpyridine is sourced from PubChem (CID 59448030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).