5-methyl-3-[(5-methyl-3-pyridinyl)methyl]-1H-pyrrolo[2,3-b]pyridine

C15H15N3 — CID 141299037

IUPAC5-methyl-3-[(5-methyl-3-pyridinyl)methyl]-1H-pyrrolo[2,3-b]pyridine
SMILESCc1cncc(Cc2c[nH]c3ncc(C)cc23)c1
InChIInChI=1S/C15H15N3/c1-10-3-12(8-16-6-10)5-13-9-18-15-14(13)4-11(2)7-17-15/h3-4,6-9H,5H2,1-2H3,(H,17,18)
InChIKeyYFMTYTAQPMUIPV-UHFFFAOYSA-N
MW237.31 g/mol
LogP3.17
Rot. Bonds2

About 5-methyl-3-[(5-methyl-3-pyridinyl)methyl]-1H-pyrrolo[2,3-b]pyridine

5-methyl-3-[(5-methyl-3-pyridinyl)methyl]-1H-pyrrolo[2,3-b]pyridine (PubChem CID 141299037) has the molecular formula C15H15N3 and a molecular weight of 237.31 g/mol. Its IUPAC name is 5-methyl-3-[(5-methyl-3-pyridinyl)methyl]-1H-pyrrolo[2,3-b]pyridine.

Molecular Properties

Compound Name5-methyl-3-[(5-methyl-3-pyridinyl)methyl]-1H-pyrrolo[2,3-b]pyridine
PubChem CID141299037
Molecular FormulaC15H15N3
Molecular Weight237.31 g/mol
Exact Mass237.13
IUPAC Name5-methyl-3-[(5-methyl-3-pyridinyl)methyl]-1H-pyrrolo[2,3-b]pyridine
SMILESCc1cncc(Cc2c[nH]c3ncc(C)cc23)c1
InChIInChI=1S/C15H15N3/c1-10-3-12(8-16-6-10)5-13-9-18-15-14(13)4-11(2)7-17-15/h3-4,6-9H,5H2,1-2H3,(H,17,18)
InChIKeyYFMTYTAQPMUIPV-UHFFFAOYSA-N
XLogP3.17
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.31
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[[2-[(1-ethylpyrazol-4-yl)methyl]pyrimidin-5-yl]methyl]-5-methyl-1H-pyrrolo[2,3-b]pyridine
CID 58485921
5-methyl-3-[[2-[[6-(trifluoromethyl)-3-pyridinyl]methyl]pyrimidin-5-yl]methyl]-1H-pyrrolo[2,3-b]pyridine
CID 58485878
N-[(2-methylphenyl)methyl]-5-[(5-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl)methyl]pyridin-2-amine
CID 58442166
5-fluoro-3-(pyrimidin-5-ylmethyl)-1H-pyrrolo[2,3-b]pyridine
CID 141299053
5-methyl-3-[[5-methyl-6-[2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridine
CID 58259413
5-methyl-3-[[2-[[3-(trifluoromethyl)-1H-pyrazol-5-yl]methyl]pyrimidin-5-yl]methyl]-1H-pyrrolo[2,3-b]pyridine
CID 58485887
3-[[2-[(3-cyclopropyl-1H-pyrazol-5-yl)methyl]pyrimidin-5-yl]methyl]-5-methyl-1H-pyrrolo[2,3-b]pyridine
CID 58485729
N-[(6-methoxy-3-pyridinyl)methyl]-5-[(5-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl)methyl]pyridin-2-amine
CID 25152109
3-[[2-[2-(2-methoxy-3-pyridinyl)ethyl]pyrimidin-5-yl]methyl]-5-methyl-1H-pyrrolo[2,3-b]pyridine
CID 58259190
3-[[6-[2-(5-fluoro-2-methoxy-3-pyridinyl)ethyl]-3-pyridinyl]methyl]-5-methyl-1H-pyrrolo[2,3-b]pyridine
CID 58258906
3-[(3-methylphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine
CID 58086816
5-chloro-3-[[2-[2-(3-methylphenyl)ethyl]pyrimidin-5-yl]methyl]-1H-pyrrolo[2,3-b]pyridine
CID 58258945

Frequently Asked Questions

What is the IUPAC name of 5-methyl-3-[(5-methyl-3-pyridinyl)methyl]-1H-pyrrolo[2,3-b]pyridine?
The IUPAC name of 5-methyl-3-[(5-methyl-3-pyridinyl)methyl]-1H-pyrrolo[2,3-b]pyridine (CID 141299037) is 5-methyl-3-[(5-methyl-3-pyridinyl)methyl]-1H-pyrrolo[2,3-b]pyridine.
What is the SMILES notation for 5-methyl-3-[(5-methyl-3-pyridinyl)methyl]-1H-pyrrolo[2,3-b]pyridine?
The canonical SMILES for 5-methyl-3-[(5-methyl-3-pyridinyl)methyl]-1H-pyrrolo[2,3-b]pyridine is Cc1cncc(Cc2c[nH]c3ncc(C)cc23)c1.
What is the InChIKey of 5-methyl-3-[(5-methyl-3-pyridinyl)methyl]-1H-pyrrolo[2,3-b]pyridine?
The InChIKey is YFMTYTAQPMUIPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3/c1-10-3-12(8-16-6-10)5-13-9-18-15-14(13)4-11(2)7-17-15/h3-4,6-9H,5H2,1-2H3,(H,17,18).
What are the key properties of 5-methyl-3-[(5-methyl-3-pyridinyl)methyl]-1H-pyrrolo[2,3-b]pyridine?
5-methyl-3-[(5-methyl-3-pyridinyl)methyl]-1H-pyrrolo[2,3-b]pyridine has a molecular weight of 237.31 g/mol, XLogP of 3.17, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-3-[(5-methyl-3-pyridinyl)methyl]-1H-pyrrolo[2,3-b]pyridine is sourced from PubChem (CID 141299037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).