5-[(2,5-dimethylpyrrol-1-yl)methyl]-2-methylpyridine

C13H16N2 — CID 62993324

IUPAC5-[(2,5-dimethylpyrrol-1-yl)methyl]-2-methylpyridine
SMILESCc1ccc(Cn2c(C)ccc2C)cn1
InChIInChI=1S/C13H16N2/c1-10-4-7-13(8-14-10)9-15-11(2)5-6-12(15)3/h4-8H,9H2,1-3H3
InChIKeyQRMMTRNPPQHZSQ-UHFFFAOYSA-N
MW200.28 g/mol
LogP2.86
Rot. Bonds2

About 5-[(2,5-dimethylpyrrol-1-yl)methyl]-2-methylpyridine

5-[(2,5-dimethylpyrrol-1-yl)methyl]-2-methylpyridine (PubChem CID 62993324) has the molecular formula C13H16N2 and a molecular weight of 200.28 g/mol. Its IUPAC name is 5-[(2,5-dimethylpyrrol-1-yl)methyl]-2-methylpyridine.

Molecular Properties

Compound Name5-[(2,5-dimethylpyrrol-1-yl)methyl]-2-methylpyridine
PubChem CID62993324
Molecular FormulaC13H16N2
Molecular Weight200.28 g/mol
Exact Mass200.13
IUPAC Name5-[(2,5-dimethylpyrrol-1-yl)methyl]-2-methylpyridine
SMILESCc1ccc(Cn2c(C)ccc2C)cn1
InChIInChI=1S/C13H16N2/c1-10-4-7-13(8-14-10)9-15-11(2)5-6-12(15)3/h4-8H,9H2,1-3H3
InChIKeyQRMMTRNPPQHZSQ-UHFFFAOYSA-N
XLogP2.86
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 52.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 5-[(2,5-dimethylpyrrol-1-yl)methyl]-2-methylpyridine with MolForge

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

Launch Full Analysis

Related Compounds

5-[(3-chloro-5-methyl-1,2,4-triazol-4-yl)methyl]-2-methylpyridine
CID 63385116
2,5-dimethyl-N-[(6-methyl-3-pyridinyl)methyl]pyrrol-1-amine
CID 104822027
2-methyl-1-[(6-methyl-3-pyridinyl)methyl]benzimidazol-5-amine
CID 62992193
2-[5-methyl-1-[(6-methyl-3-pyridinyl)methyl]imidazol-2-yl]sulfanylacetic acid
CID 81337181
(6-methyl-3-pyridinyl)methanamine;hydrobromide
CID 133057273
5-[(4,4-difluoropiperidin-1-yl)methyl]-2-methylpyridine
CID 143579558
2-[4-[(6-methyl-3-pyridinyl)methyl]piperazin-1-yl]ethanamine
CID 134406832
2,5-dimethylpyrimidine;5-ethyl-2-methylpyridine
CID 142030159
3-[(6-methyl-3-pyridinyl)methyl]-1H-imidazo[4,5-b]pyridine-2-thione
CID 79289728
2-chloro-1-[2,5-dimethyl-1-[(6-methyl-3-pyridinyl)methyl]pyrrol-3-yl]propan-1-one
CID 62990054
1-[(6-methyl-3-pyridinyl)methyl]pyrrolidin-3-one
CID 62995500
4-chloro-1-[(6-methyl-3-pyridinyl)methyl]pyrazol-5-amine
CID 104822090

Frequently Asked Questions

What is the IUPAC name of 5-[(2,5-dimethylpyrrol-1-yl)methyl]-2-methylpyridine?
The IUPAC name of 5-[(2,5-dimethylpyrrol-1-yl)methyl]-2-methylpyridine (CID 62993324) is 5-[(2,5-dimethylpyrrol-1-yl)methyl]-2-methylpyridine.
What is the SMILES notation for 5-[(2,5-dimethylpyrrol-1-yl)methyl]-2-methylpyridine?
The canonical SMILES for 5-[(2,5-dimethylpyrrol-1-yl)methyl]-2-methylpyridine is Cc1ccc(Cn2c(C)ccc2C)cn1.
What is the InChIKey of 5-[(2,5-dimethylpyrrol-1-yl)methyl]-2-methylpyridine?
The InChIKey is QRMMTRNPPQHZSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2/c1-10-4-7-13(8-14-10)9-15-11(2)5-6-12(15)3/h4-8H,9H2,1-3H3.
What are the key properties of 5-[(2,5-dimethylpyrrol-1-yl)methyl]-2-methylpyridine?
5-[(2,5-dimethylpyrrol-1-yl)methyl]-2-methylpyridine has a molecular weight of 200.28 g/mol, XLogP of 2.86, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2,5-dimethylpyrrol-1-yl)methyl]-2-methylpyridine is sourced from PubChem (CID 62993324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).