6-[(4-methylidene-1-pyridinyl)methyl]quinoline

C16H14N2 — CID 142002003

IUPAC6-[(4-methylidene-1-pyridinyl)methyl]quinoline
SMILESC=C1C=CN(Cc2ccc3ncccc3c2)C=C1
InChIInChI=1S/C16H14N2/c1-13-6-9-18(10-7-13)12-14-4-5-16-15(11-14)3-2-8-17-16/h2-11H,1,12H2
InChIKeyJCBNMBLQWXCJDJ-UHFFFAOYSA-N
MW234.30 g/mol
LogP3.63
Rot. Bonds2

About 6-[(4-methylidene-1-pyridinyl)methyl]quinoline

6-[(4-methylidene-1-pyridinyl)methyl]quinoline (PubChem CID 142002003) has the molecular formula C16H14N2 and a molecular weight of 234.30 g/mol. Its IUPAC name is 6-[(4-methylidene-1-pyridinyl)methyl]quinoline.

Molecular Properties

Compound Name6-[(4-methylidene-1-pyridinyl)methyl]quinoline
PubChem CID142002003
Molecular FormulaC16H14N2
Molecular Weight234.30 g/mol
Exact Mass234.12
IUPAC Name6-[(4-methylidene-1-pyridinyl)methyl]quinoline
SMILESC=C1C=CN(Cc2ccc3ncccc3c2)C=C1
InChIInChI=1S/C16H14N2/c1-13-6-9-18(10-7-13)12-14-4-5-16-15(11-14)3-2-8-17-16/h2-11H,1,12H2
InChIKeyJCBNMBLQWXCJDJ-UHFFFAOYSA-N
XLogP3.63
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 53.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(quinolin-6-ylmethyl)isoindole-1,3-dione
CID 23079294
6-[[4-[(3-bromophenyl)methyl]piperazin-1-yl]methyl]quinoline
CID 171999212
6-(piperazin-1-ylmethyl)quinoline;dihydrochloride
CID 82025620
6-(2-chloroethyl)quinoline
CID 53404433
6-(2-bromoethyl)quinoline
CID 68811984
6-[(4-bromoindol-1-yl)methyl]quinoline
CID 116626190
(3S)-1-(quinolin-6-ylmethyl)pyrrolidin-3-ol
CID 79031483
5-bromo-1-(quinolin-6-ylmethyl)-1,2,4-triazol-3-amine
CID 103098719
1-(quinolin-6-ylmethyl)indazol-3-amine
CID 62687491
ethyl(quinolin-6-ylmethyl)phosphane
CID 142150955
3-quinolin-6-ylpropanenitrile
CID 53417284
ethane;ethylbenzene;6-ethylquinoline
CID 143817758

Frequently Asked Questions

What is the IUPAC name of 6-[(4-methylidene-1-pyridinyl)methyl]quinoline?
The IUPAC name of 6-[(4-methylidene-1-pyridinyl)methyl]quinoline (CID 142002003) is 6-[(4-methylidene-1-pyridinyl)methyl]quinoline.
What is the SMILES notation for 6-[(4-methylidene-1-pyridinyl)methyl]quinoline?
The canonical SMILES for 6-[(4-methylidene-1-pyridinyl)methyl]quinoline is C=C1C=CN(Cc2ccc3ncccc3c2)C=C1.
What is the InChIKey of 6-[(4-methylidene-1-pyridinyl)methyl]quinoline?
The InChIKey is JCBNMBLQWXCJDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2/c1-13-6-9-18(10-7-13)12-14-4-5-16-15(11-14)3-2-8-17-16/h2-11H,1,12H2.
What are the key properties of 6-[(4-methylidene-1-pyridinyl)methyl]quinoline?
6-[(4-methylidene-1-pyridinyl)methyl]quinoline has a molecular weight of 234.30 g/mol, XLogP of 3.63, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(4-methylidene-1-pyridinyl)methyl]quinoline is sourced from PubChem (CID 142002003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).