2-[1-[(1,5-dimethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-6-(2-methylimidazol-1-yl)pyridine

C19H24N6 — CID 110253556

IUPAC2-[1-[(1,5-dimethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-6-(2-methylimidazol-1-yl)pyridine
SMILESCc1nccn1-c1cccc(C2CCCN2Cc2cnn(C)c2C)n1
InChIInChI=1S/C19H24N6/c1-14-16(12-21-23(14)3)13-24-10-5-7-18(24)17-6-4-8-19(22-17)25-11-9-20-15(25)2/h4,6,8-9,11-12,18H,5,7,10,13H2,1-3H3
InChIKeyHNERAXXHPDBCMU-UHFFFAOYSA-N
MW336.44 g/mol
LogP2.95
Rot. Bonds4

About 2-[1-[(1,5-dimethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-6-(2-methylimidazol-1-yl)pyridine

2-[1-[(1,5-dimethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-6-(2-methylimidazol-1-yl)pyridine (PubChem CID 110253556) has the molecular formula C19H24N6 and a molecular weight of 336.44 g/mol. Its IUPAC name is 2-[1-[(1,5-dimethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-6-(2-methylimidazol-1-yl)pyridine.

Molecular Properties

Compound Name2-[1-[(1,5-dimethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-6-(2-methylimidazol-1-yl)pyridine
PubChem CID110253556
Molecular FormulaC19H24N6
Molecular Weight336.44 g/mol
Exact Mass336.21
IUPAC Name2-[1-[(1,5-dimethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-6-(2-methylimidazol-1-yl)pyridine
SMILESCc1nccn1-c1cccc(C2CCCN2Cc2cnn(C)c2C)n1
InChIInChI=1S/C19H24N6/c1-14-16(12-21-23(14)3)13-24-10-5-7-18(24)17-6-4-8-19(22-17)25-11-9-20-15(25)2/h4,6,8-9,11-12,18H,5,7,10,13H2,1-3H3
InChIKeyHNERAXXHPDBCMU-UHFFFAOYSA-N
XLogP2.95
TPSA51.77 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.44
LogP ≤ 52.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[1-[(1,5-dimethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-6-(2-methylimidazol-1-yl)pyridine?
The IUPAC name of 2-[1-[(1,5-dimethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-6-(2-methylimidazol-1-yl)pyridine (CID 110253556) is 2-[1-[(1,5-dimethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-6-(2-methylimidazol-1-yl)pyridine.
What is the SMILES notation for 2-[1-[(1,5-dimethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-6-(2-methylimidazol-1-yl)pyridine?
The canonical SMILES for 2-[1-[(1,5-dimethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-6-(2-methylimidazol-1-yl)pyridine is Cc1nccn1-c1cccc(C2CCCN2Cc2cnn(C)c2C)n1.
What is the InChIKey of 2-[1-[(1,5-dimethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-6-(2-methylimidazol-1-yl)pyridine?
The InChIKey is HNERAXXHPDBCMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N6/c1-14-16(12-21-23(14)3)13-24-10-5-7-18(24)17-6-4-8-19(22-17)25-11-9-20-15(25)2/h4,6,8-9,11-12,18H,5,7,10,13H2,1-3H3.
What are the key properties of 2-[1-[(1,5-dimethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-6-(2-methylimidazol-1-yl)pyridine?
2-[1-[(1,5-dimethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-6-(2-methylimidazol-1-yl)pyridine has a molecular weight of 336.44 g/mol, XLogP of 2.95, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[(1,5-dimethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-6-(2-methylimidazol-1-yl)pyridine is sourced from PubChem (CID 110253556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).