4-(1-cyclopentyl-3,4-dihydro-2H-naphthalen-1-yl)pyridine

C20H23N — CID 158486462

IUPAC4-(1-cyclopentyl-3,4-dihydro-2H-naphthalen-1-yl)pyridine
SMILESc1ccc2c(c1)CCCC2(c1ccncc1)C1CCCC1
InChIInChI=1S/C20H23N/c1-4-10-19-16(6-1)7-5-13-20(19,17-8-2-3-9-17)18-11-14-21-15-12-18/h1,4,6,10-12,14-15,17H,2-3,5,7-9,13H2
InChIKeyHIDSMDUVYGPLGT-UHFFFAOYSA-N
MW277.41 g/mol
LogP4.89
Rot. Bonds2

About 4-(1-cyclopentyl-3,4-dihydro-2H-naphthalen-1-yl)pyridine

4-(1-cyclopentyl-3,4-dihydro-2H-naphthalen-1-yl)pyridine (PubChem CID 158486462) has the molecular formula C20H23N and a molecular weight of 277.41 g/mol. Its IUPAC name is 4-(1-cyclopentyl-3,4-dihydro-2H-naphthalen-1-yl)pyridine.

Molecular Properties

Compound Name4-(1-cyclopentyl-3,4-dihydro-2H-naphthalen-1-yl)pyridine
PubChem CID158486462
Molecular FormulaC20H23N
Molecular Weight277.41 g/mol
Exact Mass277.18
IUPAC Name4-(1-cyclopentyl-3,4-dihydro-2H-naphthalen-1-yl)pyridine
SMILESc1ccc2c(c1)CCCC2(c1ccncc1)C1CCCC1
InChIInChI=1S/C20H23N/c1-4-10-19-16(6-1)7-5-13-20(19,17-8-2-3-9-17)18-11-14-21-15-12-18/h1,4,6,10-12,14-15,17H,2-3,5,7-9,13H2
InChIKeyHIDSMDUVYGPLGT-UHFFFAOYSA-N
XLogP4.89
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.41
LogP ≤ 54.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-(1-cyclopentyl-3,4-dihydro-2H-naphthalen-1-yl)pyridine?
The IUPAC name of 4-(1-cyclopentyl-3,4-dihydro-2H-naphthalen-1-yl)pyridine (CID 158486462) is 4-(1-cyclopentyl-3,4-dihydro-2H-naphthalen-1-yl)pyridine.
What is the SMILES notation for 4-(1-cyclopentyl-3,4-dihydro-2H-naphthalen-1-yl)pyridine?
The canonical SMILES for 4-(1-cyclopentyl-3,4-dihydro-2H-naphthalen-1-yl)pyridine is c1ccc2c(c1)CCCC2(c1ccncc1)C1CCCC1.
What is the InChIKey of 4-(1-cyclopentyl-3,4-dihydro-2H-naphthalen-1-yl)pyridine?
The InChIKey is HIDSMDUVYGPLGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N/c1-4-10-19-16(6-1)7-5-13-20(19,17-8-2-3-9-17)18-11-14-21-15-12-18/h1,4,6,10-12,14-15,17H,2-3,5,7-9,13H2.
What are the key properties of 4-(1-cyclopentyl-3,4-dihydro-2H-naphthalen-1-yl)pyridine?
4-(1-cyclopentyl-3,4-dihydro-2H-naphthalen-1-yl)pyridine has a molecular weight of 277.41 g/mol, XLogP of 4.89, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-cyclopentyl-3,4-dihydro-2H-naphthalen-1-yl)pyridine is sourced from PubChem (CID 158486462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).