1-[4-[3-(cyclohexen-1-yl)phenyl]piperidin-1-yl]ethanone

C19H25NO — CID 141166525

IUPAC1-[4-[3-(cyclohexen-1-yl)phenyl]piperidin-1-yl]ethanone
SMILESCC(=O)N1CCC(c2cccc(C3=CCCCC3)c2)CC1
InChIInChI=1S/C19H25NO/c1-15(21)20-12-10-17(11-13-20)19-9-5-8-18(14-19)16-6-3-2-4-7-16/h5-6,8-9,14,17H,2-4,7,10-13H2,1H3
InChIKeyHEVYKVZIJOWDPM-UHFFFAOYSA-N
MW283.41 g/mol
LogP4.37
Rot. Bonds2

About 1-[4-[3-(cyclohexen-1-yl)phenyl]piperidin-1-yl]ethanone

1-[4-[3-(cyclohexen-1-yl)phenyl]piperidin-1-yl]ethanone (PubChem CID 141166525) has the molecular formula C19H25NO and a molecular weight of 283.41 g/mol. Its IUPAC name is 1-[4-[3-(cyclohexen-1-yl)phenyl]piperidin-1-yl]ethanone.

Molecular Properties

Compound Name1-[4-[3-(cyclohexen-1-yl)phenyl]piperidin-1-yl]ethanone
PubChem CID141166525
Molecular FormulaC19H25NO
Molecular Weight283.41 g/mol
Exact Mass283.19
IUPAC Name1-[4-[3-(cyclohexen-1-yl)phenyl]piperidin-1-yl]ethanone
SMILESCC(=O)N1CCC(c2cccc(C3=CCCCC3)c2)CC1
InChIInChI=1S/C19H25NO/c1-15(21)20-12-10-17(11-13-20)19-9-5-8-18(14-19)16-6-3-2-4-7-16/h5-6,8-9,14,17H,2-4,7,10-13H2,1H3
InChIKeyHEVYKVZIJOWDPM-UHFFFAOYSA-N
XLogP4.37
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.41
LogP ≤ 54.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-(3-phenylphenyl)piperidine-1-carboxylic acid
CID 151080045
1-[4-[4-amino-3-(cyclohexen-1-yl)phenyl]piperidin-1-yl]-2-(dimethylamino)ethanone
CID 68505177
3-(1-acetylpiperidin-4-yl)benzenecarboximidamide
CID 59887849
1-[4-(3-methylphenyl)-3,6-dihydro-2H-pyridin-1-yl]ethanone
CID 154320676
2-[3-(cyclohexen-1-yl)phenyl]acetic acid
CID 115029618
1-(4-pyridin-3-ylpiperidin-1-yl)ethanone
CID 129301457
(3S)-3-acetamido-N-[2-amino-5-(cyclohexen-1-yl)phenyl]pyrrolidine-1-carboxamide
CID 89183175
1-[4-[3-(3-chlorophenyl)azetidine-1-carbonyl]piperidin-1-yl]ethanone
CID 146150629
2-cyclopentyl-1-[4-[3-[3-(dimethylamino)phenyl]phenyl]piperidin-1-yl]ethanone
CID 171682100
1-(3-methylsulfanylphenyl)cycloheptene
CID 175668826
1-[4-phenyl-4-(4-phenylpiperidine-1-carbonyl)piperidin-1-yl]ethanone
CID 39581896
2-[3-(cyclohexen-1-yl)phenoxy]butanoic acid
CID 66680333

Frequently Asked Questions

What is the IUPAC name of 1-[4-[3-(cyclohexen-1-yl)phenyl]piperidin-1-yl]ethanone?
The IUPAC name of 1-[4-[3-(cyclohexen-1-yl)phenyl]piperidin-1-yl]ethanone (CID 141166525) is 1-[4-[3-(cyclohexen-1-yl)phenyl]piperidin-1-yl]ethanone.
What is the SMILES notation for 1-[4-[3-(cyclohexen-1-yl)phenyl]piperidin-1-yl]ethanone?
The canonical SMILES for 1-[4-[3-(cyclohexen-1-yl)phenyl]piperidin-1-yl]ethanone is CC(=O)N1CCC(c2cccc(C3=CCCCC3)c2)CC1.
What is the InChIKey of 1-[4-[3-(cyclohexen-1-yl)phenyl]piperidin-1-yl]ethanone?
The InChIKey is HEVYKVZIJOWDPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO/c1-15(21)20-12-10-17(11-13-20)19-9-5-8-18(14-19)16-6-3-2-4-7-16/h5-6,8-9,14,17H,2-4,7,10-13H2,1H3.
What are the key properties of 1-[4-[3-(cyclohexen-1-yl)phenyl]piperidin-1-yl]ethanone?
1-[4-[3-(cyclohexen-1-yl)phenyl]piperidin-1-yl]ethanone has a molecular weight of 283.41 g/mol, XLogP of 4.37, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[3-(cyclohexen-1-yl)phenyl]piperidin-1-yl]ethanone is sourced from PubChem (CID 141166525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).