2-[(4-naphthalen-1-ylnaphthalen-1-yl)methyl]pyridine

C26H19N — CID 58939537

IUPAC2-[(4-naphthalen-1-ylnaphthalen-1-yl)methyl]pyridine
SMILESc1ccc(Cc2ccc(-c3cccc4ccccc34)c3ccccc23)nc1
InChIInChI=1S/C26H19N/c1-2-11-22-19(8-1)9-7-14-25(22)26-16-15-20(18-21-10-5-6-17-27-21)23-12-3-4-13-24(23)26/h1-17H,18H2
InChIKeyUUKDBUVOXBLWGA-UHFFFAOYSA-N
MW345.45 g/mol
LogP6.65
Rot. Bonds3

About 2-[(4-naphthalen-1-ylnaphthalen-1-yl)methyl]pyridine

2-[(4-naphthalen-1-ylnaphthalen-1-yl)methyl]pyridine (PubChem CID 58939537) has the molecular formula C26H19N and a molecular weight of 345.45 g/mol. Its IUPAC name is 2-[(4-naphthalen-1-ylnaphthalen-1-yl)methyl]pyridine.

Molecular Properties

Compound Name2-[(4-naphthalen-1-ylnaphthalen-1-yl)methyl]pyridine
PubChem CID58939537
Molecular FormulaC26H19N
Molecular Weight345.45 g/mol
Exact Mass345.15
IUPAC Name2-[(4-naphthalen-1-ylnaphthalen-1-yl)methyl]pyridine
SMILESc1ccc(Cc2ccc(-c3cccc4ccccc34)c3ccccc23)nc1
InChIInChI=1S/C26H19N/c1-2-11-22-19(8-1)9-7-14-25(22)26-16-15-20(18-21-10-5-6-17-27-21)23-12-3-4-13-24(23)26/h1-17H,18H2
InChIKeyUUKDBUVOXBLWGA-UHFFFAOYSA-N
XLogP6.65
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500345.45
LogP ≤ 56.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-naphthalen-1-yl-4-(5-naphthalen-1-ylnaphthalen-1-yl)naphthalene
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CID 11327769
CID 175282704
CID 175282704
bis(1-naphthalen-1-ylnaphthalene);phosphane
CID 175426418
tetrakis(1-naphthalen-1-ylnaphthalene);tetrahydrochloride
CID 173126408
1-naphthalen-1-ylnaphthalene;tetrahydrochloride
CID 68981096
4-(4-naphthalen-1-ylnaphthalen-1-yl)quinoline
CID 71174827
1-naphthalen-1-yl-N-(pyridin-2-ylmethyl)methanamine
CID 935553
naphthalen-1-ylmethyl(pyridin-2-ylmethyl)azanium
CID 7480921
[4-(aminomethyl)-2,3-bis(pyridin-2-ylmethyl)phenyl]methanamine
CID 68592017
5-naphthalen-1-ylquinolin-8-ol;zinc
CID 20606771
9-naphthalen-1-yl-10-[4-[4-(10-naphthalen-1-ylanthracen-9-yl)naphthalen-1-yl]naphthalen-1-yl]anthracene
CID 59861499

Frequently Asked Questions

What is the IUPAC name of 2-[(4-naphthalen-1-ylnaphthalen-1-yl)methyl]pyridine?
The IUPAC name of 2-[(4-naphthalen-1-ylnaphthalen-1-yl)methyl]pyridine (CID 58939537) is 2-[(4-naphthalen-1-ylnaphthalen-1-yl)methyl]pyridine.
What is the SMILES notation for 2-[(4-naphthalen-1-ylnaphthalen-1-yl)methyl]pyridine?
The canonical SMILES for 2-[(4-naphthalen-1-ylnaphthalen-1-yl)methyl]pyridine is c1ccc(Cc2ccc(-c3cccc4ccccc34)c3ccccc23)nc1.
What is the InChIKey of 2-[(4-naphthalen-1-ylnaphthalen-1-yl)methyl]pyridine?
The InChIKey is UUKDBUVOXBLWGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H19N/c1-2-11-22-19(8-1)9-7-14-25(22)26-16-15-20(18-21-10-5-6-17-27-21)23-12-3-4-13-24(23)26/h1-17H,18H2.
What are the key properties of 2-[(4-naphthalen-1-ylnaphthalen-1-yl)methyl]pyridine?
2-[(4-naphthalen-1-ylnaphthalen-1-yl)methyl]pyridine has a molecular weight of 345.45 g/mol, XLogP of 6.65, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-naphthalen-1-ylnaphthalen-1-yl)methyl]pyridine is sourced from PubChem (CID 58939537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).