2-[(2,3-dimethyl-3H-inden-1-yl)methyl]pyridine

C17H17N — CID 143663893

IUPAC2-[(2,3-dimethyl-3H-inden-1-yl)methyl]pyridine
SMILESCC1=C(Cc2ccccn2)c2ccccc2C1C
InChIInChI=1S/C17H17N/c1-12-13(2)17(11-14-7-5-6-10-18-14)16-9-4-3-8-15(12)16/h3-10,12H,11H2,1-2H3
InChIKeyXMNCJPZLNXSFIF-UHFFFAOYSA-N
MW235.33 g/mol
LogP4.21
Rot. Bonds2

About 2-[(2,3-dimethyl-3H-inden-1-yl)methyl]pyridine

2-[(2,3-dimethyl-3H-inden-1-yl)methyl]pyridine (PubChem CID 143663893) has the molecular formula C17H17N and a molecular weight of 235.33 g/mol. Its IUPAC name is 2-[(2,3-dimethyl-3H-inden-1-yl)methyl]pyridine.

Molecular Properties

Compound Name2-[(2,3-dimethyl-3H-inden-1-yl)methyl]pyridine
PubChem CID143663893
Molecular FormulaC17H17N
Molecular Weight235.33 g/mol
Exact Mass235.14
IUPAC Name2-[(2,3-dimethyl-3H-inden-1-yl)methyl]pyridine
SMILESCC1=C(Cc2ccccn2)c2ccccc2C1C
InChIInChI=1S/C17H17N/c1-12-13(2)17(11-14-7-5-6-10-18-14)16-9-4-3-8-15(12)16/h3-10,12H,11H2,1-2H3
InChIKeyXMNCJPZLNXSFIF-UHFFFAOYSA-N
XLogP4.21
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 54.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

ethane;propane;1,2,3-trimethyl-1H-indene
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CID 58566955
2-[[3,5-bis(pyridin-2-ylmethyl)phenyl]methyl]pyridine
CID 102075718
2-ethylpyridine;2-methylpyridine
CID 19020939
2-[[3-[(3-methylcyclohexa-1,5-dien-1-yl)methyl]-3H-inden-1-yl]methyl]pyridine
CID 143823167
ethane;2-methylpyridine;pyridin-2-ylmethanamine
CID 158124738
N-methyl-1-[4-methyl-2-(pyridin-2-ylmethyl)pyrimidin-5-yl]ethanamine
CID 62769957
3-(pyridin-2-ylmethyl)naphthalene-1,2-dione
CID 141348800
ethane;pyridin-2-ylmethanamine
CID 90791011
2-ethylpyridine;sulfane
CID 67363352
ethane;2-ethylpyridine
CID 91102000

Frequently Asked Questions

What is the IUPAC name of 2-[(2,3-dimethyl-3H-inden-1-yl)methyl]pyridine?
The IUPAC name of 2-[(2,3-dimethyl-3H-inden-1-yl)methyl]pyridine (CID 143663893) is 2-[(2,3-dimethyl-3H-inden-1-yl)methyl]pyridine.
What is the SMILES notation for 2-[(2,3-dimethyl-3H-inden-1-yl)methyl]pyridine?
The canonical SMILES for 2-[(2,3-dimethyl-3H-inden-1-yl)methyl]pyridine is CC1=C(Cc2ccccn2)c2ccccc2C1C.
What is the InChIKey of 2-[(2,3-dimethyl-3H-inden-1-yl)methyl]pyridine?
The InChIKey is XMNCJPZLNXSFIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N/c1-12-13(2)17(11-14-7-5-6-10-18-14)16-9-4-3-8-15(12)16/h3-10,12H,11H2,1-2H3.
What are the key properties of 2-[(2,3-dimethyl-3H-inden-1-yl)methyl]pyridine?
2-[(2,3-dimethyl-3H-inden-1-yl)methyl]pyridine has a molecular weight of 235.33 g/mol, XLogP of 4.21, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,3-dimethyl-3H-inden-1-yl)methyl]pyridine is sourced from PubChem (CID 143663893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).