2-(cyclooctylamino)-1-(4-ethylphenyl)ethanone

C18H27NO — CID 82101307

IUPAC2-(cyclooctylamino)-1-(4-ethylphenyl)ethanone
SMILESCCc1ccc(C(=O)CNC2CCCCCCC2)cc1
InChIInChI=1S/C18H27NO/c1-2-15-10-12-16(13-11-15)18(20)14-19-17-8-6-4-3-5-7-9-17/h10-13,17,19H,2-9,14H2,1H3
InChIKeyKNBJCAIUOVNPKB-UHFFFAOYSA-N
MW273.42 g/mol
LogP4.13
Rot. Bonds5

About 2-(cyclooctylamino)-1-(4-ethylphenyl)ethanone

2-(cyclooctylamino)-1-(4-ethylphenyl)ethanone (PubChem CID 82101307) has the molecular formula C18H27NO and a molecular weight of 273.42 g/mol. Its IUPAC name is 2-(cyclooctylamino)-1-(4-ethylphenyl)ethanone.

Molecular Properties

Compound Name2-(cyclooctylamino)-1-(4-ethylphenyl)ethanone
PubChem CID82101307
Molecular FormulaC18H27NO
Molecular Weight273.42 g/mol
Exact Mass273.21
IUPAC Name2-(cyclooctylamino)-1-(4-ethylphenyl)ethanone
SMILESCCc1ccc(C(=O)CNC2CCCCCCC2)cc1
InChIInChI=1S/C18H27NO/c1-2-15-10-12-16(13-11-15)18(20)14-19-17-8-6-4-3-5-7-9-17/h10-13,17,19H,2-9,14H2,1H3
InChIKeyKNBJCAIUOVNPKB-UHFFFAOYSA-N
XLogP4.13
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.42
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-tert-butylphenyl)-2-(cycloheptylamino)ethanone
CID 82101744
1-(4-tert-butylphenyl)-2-(cyclohexylamino)ethanone
CID 82101742
1-(4-aminophenyl)-2-(cyclohexylamino)ethanone
CID 82258202
2-(cycloheptylamino)-1-(4-methoxyphenyl)ethanone
CID 2404150
1-(4-aminophenyl)-2-(cyclopentylamino)ethanone
CID 82258201
N-cyclohexyl-2-(4-ethylphenyl)-2-oxoacetamide
CID 82121266
2-(cyclooctylamino)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanone
CID 82101392
2-(cyclopentylamino)-1-(4-cyclopropyloxyphenyl)ethanone
CID 114520577
2-(cyclopentylamino)-1-(3,4-dimethoxyphenyl)ethanone
CID 82102039
2-(cyclopentylamino)-1-(4-fluoro-3-methylphenyl)ethanone
CID 82116606
2-(cyclopentylamino)-1-(4-ethylphenyl)propan-1-one
CID 82100230
2-(cyclohexylamino)-1-(2,3-dihydro-1H-indol-5-yl)ethanone
CID 82257913

Frequently Asked Questions

What is the IUPAC name of 2-(cyclooctylamino)-1-(4-ethylphenyl)ethanone?
The IUPAC name of 2-(cyclooctylamino)-1-(4-ethylphenyl)ethanone (CID 82101307) is 2-(cyclooctylamino)-1-(4-ethylphenyl)ethanone.
What is the SMILES notation for 2-(cyclooctylamino)-1-(4-ethylphenyl)ethanone?
The canonical SMILES for 2-(cyclooctylamino)-1-(4-ethylphenyl)ethanone is CCc1ccc(C(=O)CNC2CCCCCCC2)cc1.
What is the InChIKey of 2-(cyclooctylamino)-1-(4-ethylphenyl)ethanone?
The InChIKey is KNBJCAIUOVNPKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27NO/c1-2-15-10-12-16(13-11-15)18(20)14-19-17-8-6-4-3-5-7-9-17/h10-13,17,19H,2-9,14H2,1H3.
What are the key properties of 2-(cyclooctylamino)-1-(4-ethylphenyl)ethanone?
2-(cyclooctylamino)-1-(4-ethylphenyl)ethanone has a molecular weight of 273.42 g/mol, XLogP of 4.13, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclooctylamino)-1-(4-ethylphenyl)ethanone is sourced from PubChem (CID 82101307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).