(4-cyclohexylphenyl)-pyridin-4-ylmethanone

C18H19NO — CID 43160506

IUPAC(4-cyclohexylphenyl)-pyridin-4-ylmethanone
SMILESO=C(c1ccncc1)c1ccc(C2CCCCC2)cc1
InChIInChI=1S/C18H19NO/c20-18(17-10-12-19-13-11-17)16-8-6-15(7-9-16)14-4-2-1-3-5-14/h6-14H,1-5H2
InChIKeyJBWPVSNJSFUGNC-UHFFFAOYSA-N
MW265.36 g/mol
LogP4.36
Rot. Bonds3

About (4-cyclohexylphenyl)-pyridin-4-ylmethanone

(4-cyclohexylphenyl)-pyridin-4-ylmethanone (PubChem CID 43160506) has the molecular formula C18H19NO and a molecular weight of 265.36 g/mol. Its IUPAC name is (4-cyclohexylphenyl)-pyridin-4-ylmethanone.

Molecular Properties

Compound Name(4-cyclohexylphenyl)-pyridin-4-ylmethanone
PubChem CID43160506
Molecular FormulaC18H19NO
Molecular Weight265.36 g/mol
Exact Mass265.15
IUPAC Name(4-cyclohexylphenyl)-pyridin-4-ylmethanone
SMILESO=C(c1ccncc1)c1ccc(C2CCCCC2)cc1
InChIInChI=1S/C18H19NO/c20-18(17-10-12-19-13-11-17)16-8-6-15(7-9-16)14-4-2-1-3-5-14/h6-14H,1-5H2
InChIKeyJBWPVSNJSFUGNC-UHFFFAOYSA-N
XLogP4.36
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 54.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4-cyclohexylphenyl)-pyridin-4-ylmethanone?
The IUPAC name of (4-cyclohexylphenyl)-pyridin-4-ylmethanone (CID 43160506) is (4-cyclohexylphenyl)-pyridin-4-ylmethanone.
What is the SMILES notation for (4-cyclohexylphenyl)-pyridin-4-ylmethanone?
The canonical SMILES for (4-cyclohexylphenyl)-pyridin-4-ylmethanone is O=C(c1ccncc1)c1ccc(C2CCCCC2)cc1.
What is the InChIKey of (4-cyclohexylphenyl)-pyridin-4-ylmethanone?
The InChIKey is JBWPVSNJSFUGNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19NO/c20-18(17-10-12-19-13-11-17)16-8-6-15(7-9-16)14-4-2-1-3-5-14/h6-14H,1-5H2.
What are the key properties of (4-cyclohexylphenyl)-pyridin-4-ylmethanone?
(4-cyclohexylphenyl)-pyridin-4-ylmethanone has a molecular weight of 265.36 g/mol, XLogP of 4.36, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-cyclohexylphenyl)-pyridin-4-ylmethanone is sourced from PubChem (CID 43160506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).