6-deuterio-1,6-diphenyl-5,7-dihydrocyclopenta[c]pyridine

C20H17N — CID 163644240

IUPAC6-deuterio-1,6-diphenyl-5,7-dihydrocyclopenta[c]pyridine
SMILES[2H]C1(c2ccccc2)Cc2ccnc(-c3ccccc3)c2C1
InChIInChI=1S/C20H17N/c1-3-7-15(8-4-1)18-13-17-11-12-21-20(19(17)14-18)16-9-5-2-6-10-16/h1-12,18H,13-14H2/i18D
InChIKeyWRXCQAQHJMEUFI-VAAKKRCDSA-N
MW272.37 g/mol
LogP4.63
Rot. Bonds2

About 6-deuterio-1,6-diphenyl-5,7-dihydrocyclopenta[c]pyridine

6-deuterio-1,6-diphenyl-5,7-dihydrocyclopenta[c]pyridine (PubChem CID 163644240) has the molecular formula C20H17N and a molecular weight of 272.37 g/mol. Its IUPAC name is 6-deuterio-1,6-diphenyl-5,7-dihydrocyclopenta[c]pyridine.

Molecular Properties

Compound Name6-deuterio-1,6-diphenyl-5,7-dihydrocyclopenta[c]pyridine
PubChem CID163644240
Molecular FormulaC20H17N
Molecular Weight272.37 g/mol
Exact Mass272.14
IUPAC Name6-deuterio-1,6-diphenyl-5,7-dihydrocyclopenta[c]pyridine
SMILES[2H]C1(c2ccccc2)Cc2ccnc(-c3ccccc3)c2C1
InChIInChI=1S/C20H17N/c1-3-7-15(8-4-1)18-13-17-11-12-21-20(19(17)14-18)16-9-5-2-6-10-16/h1-12,18H,13-14H2/i18D
InChIKeyWRXCQAQHJMEUFI-VAAKKRCDSA-N
XLogP4.63
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.37
LogP ≤ 54.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1'-phenylspiro[1,3-dihydroindene-2,6'-5,7-dihydrocyclopenta[c]pyridine]
CID 164727571
4-phenyl-2,3-dihydrofuro[3,2-c]pyridine
CID 10535928
4-phenyl-1,2-dihydropyrrolo[3,4-c]pyridin-3-one
CID 137378956
4-phenyl-3H-furo[3,4-c]pyridin-1-one
CID 69259082
3-phenyl-1,4-oxazin-2-one
CID 135005028
4-cyclopropyl-3-methyl-2-phenylpyridine
CID 152579101
4-(2,6-dideuterio-6-phenyl-2-adamantyl)-2-phenylpyridine
CID 159088701
2,3-diphenylpyrazine;pyridine
CID 175017097
2-(2-phenyl-3-pyridinyl)pyrimidine
CID 58421043
2-phenyl-3-[2-[2-(2-phenyl-3-pyridinyl)phenyl]phenyl]pyridine
CID 58947757
6-phenyl-6,7-dihydro-5H-quinolin-8-one
CID 12036201
2,4-dimethyl-7-phenyl-5,6-dihydro-3,8-phenanthroline
CID 170055106

Frequently Asked Questions

What is the IUPAC name of 6-deuterio-1,6-diphenyl-5,7-dihydrocyclopenta[c]pyridine?
The IUPAC name of 6-deuterio-1,6-diphenyl-5,7-dihydrocyclopenta[c]pyridine (CID 163644240) is 6-deuterio-1,6-diphenyl-5,7-dihydrocyclopenta[c]pyridine.
What is the SMILES notation for 6-deuterio-1,6-diphenyl-5,7-dihydrocyclopenta[c]pyridine?
The canonical SMILES for 6-deuterio-1,6-diphenyl-5,7-dihydrocyclopenta[c]pyridine is [2H]C1(c2ccccc2)Cc2ccnc(-c3ccccc3)c2C1.
What is the InChIKey of 6-deuterio-1,6-diphenyl-5,7-dihydrocyclopenta[c]pyridine?
The InChIKey is WRXCQAQHJMEUFI-VAAKKRCDSA-N. The full InChI is InChI=1S/C20H17N/c1-3-7-15(8-4-1)18-13-17-11-12-21-20(19(17)14-18)16-9-5-2-6-10-16/h1-12,18H,13-14H2/i18D.
What are the key properties of 6-deuterio-1,6-diphenyl-5,7-dihydrocyclopenta[c]pyridine?
6-deuterio-1,6-diphenyl-5,7-dihydrocyclopenta[c]pyridine has a molecular weight of 272.37 g/mol, XLogP of 4.63, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-deuterio-1,6-diphenyl-5,7-dihydrocyclopenta[c]pyridine is sourced from PubChem (CID 163644240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).