2-(2-methylpyrazol-3-yl)-4-[(1-propan-2-ylpiperidin-4-yl)methyl]pyridine

C18H26N4 — CID 110102016

IUPAC2-(2-methylpyrazol-3-yl)-4-[(1-propan-2-ylpiperidin-4-yl)methyl]pyridine
SMILESCC(C)N1CCC(Cc2ccnc(-c3ccnn3C)c2)CC1
InChIInChI=1S/C18H26N4/c1-14(2)22-10-6-15(7-11-22)12-16-4-8-19-17(13-16)18-5-9-20-21(18)3/h4-5,8-9,13-15H,6-7,10-12H2,1-3H3
InChIKeyMBEQXEWQUAILMC-UHFFFAOYSA-N
MW298.43 g/mol
LogP3.14
Rot. Bonds4

About 2-(2-methylpyrazol-3-yl)-4-[(1-propan-2-ylpiperidin-4-yl)methyl]pyridine

2-(2-methylpyrazol-3-yl)-4-[(1-propan-2-ylpiperidin-4-yl)methyl]pyridine (PubChem CID 110102016) has the molecular formula C18H26N4 and a molecular weight of 298.43 g/mol. Its IUPAC name is 2-(2-methylpyrazol-3-yl)-4-[(1-propan-2-ylpiperidin-4-yl)methyl]pyridine.

Molecular Properties

Compound Name2-(2-methylpyrazol-3-yl)-4-[(1-propan-2-ylpiperidin-4-yl)methyl]pyridine
PubChem CID110102016
Molecular FormulaC18H26N4
Molecular Weight298.43 g/mol
Exact Mass298.22
IUPAC Name2-(2-methylpyrazol-3-yl)-4-[(1-propan-2-ylpiperidin-4-yl)methyl]pyridine
SMILESCC(C)N1CCC(Cc2ccnc(-c3ccnn3C)c2)CC1
InChIInChI=1S/C18H26N4/c1-14(2)22-10-6-15(7-11-22)12-16-4-8-19-17(13-16)18-5-9-20-21(18)3/h4-5,8-9,13-15H,6-7,10-12H2,1-3H3
InChIKeyMBEQXEWQUAILMC-UHFFFAOYSA-N
XLogP3.14
TPSA33.95 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.43
LogP ≤ 53.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-(2-methylpyrazol-3-yl)-4-[(1-propan-2-ylpiperidin-4-yl)methyl]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylpyrazol-3-yl)-4-[(1-propan-2-ylpiperidin-4-yl)methyl]pyridine?
The IUPAC name of 2-(2-methylpyrazol-3-yl)-4-[(1-propan-2-ylpiperidin-4-yl)methyl]pyridine (CID 110102016) is 2-(2-methylpyrazol-3-yl)-4-[(1-propan-2-ylpiperidin-4-yl)methyl]pyridine.
What is the SMILES notation for 2-(2-methylpyrazol-3-yl)-4-[(1-propan-2-ylpiperidin-4-yl)methyl]pyridine?
The canonical SMILES for 2-(2-methylpyrazol-3-yl)-4-[(1-propan-2-ylpiperidin-4-yl)methyl]pyridine is CC(C)N1CCC(Cc2ccnc(-c3ccnn3C)c2)CC1.
What is the InChIKey of 2-(2-methylpyrazol-3-yl)-4-[(1-propan-2-ylpiperidin-4-yl)methyl]pyridine?
The InChIKey is MBEQXEWQUAILMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N4/c1-14(2)22-10-6-15(7-11-22)12-16-4-8-19-17(13-16)18-5-9-20-21(18)3/h4-5,8-9,13-15H,6-7,10-12H2,1-3H3.
What are the key properties of 2-(2-methylpyrazol-3-yl)-4-[(1-propan-2-ylpiperidin-4-yl)methyl]pyridine?
2-(2-methylpyrazol-3-yl)-4-[(1-propan-2-ylpiperidin-4-yl)methyl]pyridine has a molecular weight of 298.43 g/mol, XLogP of 3.14, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylpyrazol-3-yl)-4-[(1-propan-2-ylpiperidin-4-yl)methyl]pyridine is sourced from PubChem (CID 110102016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).