4-[(Z)-(6-methyl-2,3-dihydroinden-1-ylidene)methyl]pyridine

C16H15N — CID 6539804

IUPAC4-[(Z)-(6-methyl-2,3-dihydroinden-1-ylidene)methyl]pyridine
SMILESCc1ccc2c(c1)/C(=C\c1ccncc1)CC2
InChIInChI=1S/C16H15N/c1-12-2-3-14-4-5-15(16(14)10-12)11-13-6-8-17-9-7-13/h2-3,6-11H,4-5H2,1H3/b15-11-
InChIKeyJRWJGUYEZHCVMC-PTNGSMBKSA-N
MW221.30 g/mol
LogP3.88
Rot. Bonds1

About 4-[(Z)-(6-methyl-2,3-dihydroinden-1-ylidene)methyl]pyridine

4-[(Z)-(6-methyl-2,3-dihydroinden-1-ylidene)methyl]pyridine (PubChem CID 6539804) has the molecular formula C16H15N and a molecular weight of 221.30 g/mol. Its IUPAC name is 4-[(Z)-(6-methyl-2,3-dihydroinden-1-ylidene)methyl]pyridine.

Molecular Properties

Compound Name4-[(Z)-(6-methyl-2,3-dihydroinden-1-ylidene)methyl]pyridine
PubChem CID6539804
Molecular FormulaC16H15N
Molecular Weight221.30 g/mol
Exact Mass221.12
IUPAC Name4-[(Z)-(6-methyl-2,3-dihydroinden-1-ylidene)methyl]pyridine
SMILESCc1ccc2c(c1)/C(=C\c1ccncc1)CC2
InChIInChI=1S/C16H15N/c1-12-2-3-14-4-5-15(16(14)10-12)11-13-6-8-17-9-7-13/h2-3,6-11H,4-5H2,1H3/b15-11-
InChIKeyJRWJGUYEZHCVMC-PTNGSMBKSA-N
XLogP3.88
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 53.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-[(Z)-(6-methyl-2,3-dihydroinden-1-ylidene)methyl]pyridine?
The IUPAC name of 4-[(Z)-(6-methyl-2,3-dihydroinden-1-ylidene)methyl]pyridine (CID 6539804) is 4-[(Z)-(6-methyl-2,3-dihydroinden-1-ylidene)methyl]pyridine.
What is the SMILES notation for 4-[(Z)-(6-methyl-2,3-dihydroinden-1-ylidene)methyl]pyridine?
The canonical SMILES for 4-[(Z)-(6-methyl-2,3-dihydroinden-1-ylidene)methyl]pyridine is Cc1ccc2c(c1)/C(=C\c1ccncc1)CC2.
What is the InChIKey of 4-[(Z)-(6-methyl-2,3-dihydroinden-1-ylidene)methyl]pyridine?
The InChIKey is JRWJGUYEZHCVMC-PTNGSMBKSA-N. The full InChI is InChI=1S/C16H15N/c1-12-2-3-14-4-5-15(16(14)10-12)11-13-6-8-17-9-7-13/h2-3,6-11H,4-5H2,1H3/b15-11-.
What are the key properties of 4-[(Z)-(6-methyl-2,3-dihydroinden-1-ylidene)methyl]pyridine?
4-[(Z)-(6-methyl-2,3-dihydroinden-1-ylidene)methyl]pyridine has a molecular weight of 221.30 g/mol, XLogP of 3.88, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(Z)-(6-methyl-2,3-dihydroinden-1-ylidene)methyl]pyridine is sourced from PubChem (CID 6539804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).