1-(4-cyclohexylphenyl)-2-pyridin-4-ylethanone

C19H21NO — CID 22282352

IUPAC1-(4-cyclohexylphenyl)-2-pyridin-4-ylethanone
SMILESO=C(Cc1ccncc1)c1ccc(C2CCCCC2)cc1
InChIInChI=1S/C19H21NO/c21-19(14-15-10-12-20-13-11-15)18-8-6-17(7-9-18)16-4-2-1-3-5-16/h6-13,16H,1-5,14H2
InChIKeyIEXOEWSIWACRSN-UHFFFAOYSA-N
MW279.38 g/mol
LogP4.55
Rot. Bonds4

About 1-(4-cyclohexylphenyl)-2-pyridin-4-ylethanone

1-(4-cyclohexylphenyl)-2-pyridin-4-ylethanone (PubChem CID 22282352) has the molecular formula C19H21NO and a molecular weight of 279.38 g/mol. Its IUPAC name is 1-(4-cyclohexylphenyl)-2-pyridin-4-ylethanone.

Molecular Properties

Compound Name1-(4-cyclohexylphenyl)-2-pyridin-4-ylethanone
PubChem CID22282352
Molecular FormulaC19H21NO
Molecular Weight279.38 g/mol
Exact Mass279.16
IUPAC Name1-(4-cyclohexylphenyl)-2-pyridin-4-ylethanone
SMILESO=C(Cc1ccncc1)c1ccc(C2CCCCC2)cc1
InChIInChI=1S/C19H21NO/c21-19(14-15-10-12-20-13-11-15)18-8-6-17(7-9-18)16-4-2-1-3-5-16/h6-13,16H,1-5,14H2
InChIKeyIEXOEWSIWACRSN-UHFFFAOYSA-N
XLogP4.55
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 54.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-[4-[(4-cyclopropylphenyl)methoxy]phenyl]-2-pyridin-4-ylethanone
CID 118408149
(4-cyclohexylphenyl)-pyridin-4-ylmethanone
CID 43160506
1-(4-cyclobutylphenyl)-2-pyridin-3-ylethanone
CID 116505569
2-(4-aminophenyl)-1-(4-cyclobutylphenyl)ethanone
CID 116549633
2-bromo-1-(4-cyclohexylphenyl)ethanone
CID 2756899
1-(4-cycloheptylphenyl)propan-1-one
CID 174630933
1-(4-hydroxyphenyl)-2-pyridin-4-ylethanone
CID 22707004
4-(4-cyclohexylphenyl)-4-oxobutanal
CID 175457718
1-(4-methylphenyl)-2-pyridin-4-ylethanone
CID 11367827
2-(4-cycloheptylphenyl)acetic acid
CID 21484425
1-(4-cycloheptylphenyl)-2-imidazol-1-ylethanone
CID 54279792
4-cyclopentyl-N-pyridin-4-ylbenzamide
CID 110464379

Frequently Asked Questions

What is the IUPAC name of 1-(4-cyclohexylphenyl)-2-pyridin-4-ylethanone?
The IUPAC name of 1-(4-cyclohexylphenyl)-2-pyridin-4-ylethanone (CID 22282352) is 1-(4-cyclohexylphenyl)-2-pyridin-4-ylethanone.
What is the SMILES notation for 1-(4-cyclohexylphenyl)-2-pyridin-4-ylethanone?
The canonical SMILES for 1-(4-cyclohexylphenyl)-2-pyridin-4-ylethanone is O=C(Cc1ccncc1)c1ccc(C2CCCCC2)cc1.
What is the InChIKey of 1-(4-cyclohexylphenyl)-2-pyridin-4-ylethanone?
The InChIKey is IEXOEWSIWACRSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21NO/c21-19(14-15-10-12-20-13-11-15)18-8-6-17(7-9-18)16-4-2-1-3-5-16/h6-13,16H,1-5,14H2.
What are the key properties of 1-(4-cyclohexylphenyl)-2-pyridin-4-ylethanone?
1-(4-cyclohexylphenyl)-2-pyridin-4-ylethanone has a molecular weight of 279.38 g/mol, XLogP of 4.55, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-cyclohexylphenyl)-2-pyridin-4-ylethanone is sourced from PubChem (CID 22282352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).