1-(3-fluorophenyl)-N-(2-hydroxyethyl)cyclohexane-1-carboxamide

C15H20FNO2 — CID 110904346

IUPAC1-(3-fluorophenyl)-N-(2-hydroxyethyl)cyclohexane-1-carboxamide
SMILESO=C(NCCO)C1(c2cccc(F)c2)CCCCC1
InChIInChI=1S/C15H20FNO2/c16-13-6-4-5-12(11-13)15(7-2-1-3-8-15)14(19)17-9-10-18/h4-6,11,18H,1-3,7-10H2,(H,17,19)
InChIKeyZTIPWFJYGCMWSE-UHFFFAOYSA-N
MW265.33 g/mol
LogP2.14
Rot. Bonds4

About 1-(3-fluorophenyl)-N-(2-hydroxyethyl)cyclohexane-1-carboxamide

1-(3-fluorophenyl)-N-(2-hydroxyethyl)cyclohexane-1-carboxamide (PubChem CID 110904346) has the molecular formula C15H20FNO2 and a molecular weight of 265.33 g/mol. Its IUPAC name is 1-(3-fluorophenyl)-N-(2-hydroxyethyl)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name1-(3-fluorophenyl)-N-(2-hydroxyethyl)cyclohexane-1-carboxamide
PubChem CID110904346
Molecular FormulaC15H20FNO2
Molecular Weight265.33 g/mol
Exact Mass265.15
IUPAC Name1-(3-fluorophenyl)-N-(2-hydroxyethyl)cyclohexane-1-carboxamide
SMILESO=C(NCCO)C1(c2cccc(F)c2)CCCCC1
InChIInChI=1S/C15H20FNO2/c16-13-6-4-5-12(11-13)15(7-2-1-3-8-15)14(19)17-9-10-18/h4-6,11,18H,1-3,7-10H2,(H,17,19)
InChIKeyZTIPWFJYGCMWSE-UHFFFAOYSA-N
XLogP2.14
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.33
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3-fluorophenyl)-N-[2-(methylamino)ethyl]cyclobutane-1-carboxamide
CID 119500175
N-(3-aminobutyl)-1-(3-fluorophenyl)cyclohexane-1-carboxamide;hydrochloride
CID 119495759
1-(3-fluorophenyl)-N-[(1-hydroxycyclobutyl)methyl]cyclohexane-1-carboxamide
CID 111445692
N-(2-ethoxyethyl)-1-(3-fluorophenyl)cyclopentane-1-carboxamide
CID 60557792
2-[[1-(3-fluorophenyl)cyclobutanecarbonyl]amino]acetic acid
CID 119171698
N-[2-(benzenesulfonamido)ethyl]-1-(3-fluorophenyl)cyclopentane-1-carboxamide
CID 86922420
1-(3-fluorophenyl)-N-(2-pyrrolidin-3-ylethyl)cyclohexane-1-carboxamide
CID 119534325
N-[2-(4-aminophenyl)ethyl]-1-(3-fluorophenyl)cyclobutane-1-carboxamide;hydrochloride
CID 119547553
3-[[1-(3-fluorophenyl)cyclopentanecarbonyl]amino]-2,2-dimethylpropanoic acid
CID 119249767
N-[(2R)-2-(ethylamino)propyl]-1-(3-fluorophenyl)cyclohexane-1-carboxamide
CID 120651377
N-[2-(2-amino-2-oxoethoxy)ethyl]-1-(3-fluorophenyl)cyclobutane-1-carboxamide
CID 75381149
N-[2-[(S)-tert-butylsulfinyl]ethyl]-1-(3-fluorophenyl)cyclobutane-1-carboxamide
CID 95623396

Frequently Asked Questions

What is the IUPAC name of 1-(3-fluorophenyl)-N-(2-hydroxyethyl)cyclohexane-1-carboxamide?
The IUPAC name of 1-(3-fluorophenyl)-N-(2-hydroxyethyl)cyclohexane-1-carboxamide (CID 110904346) is 1-(3-fluorophenyl)-N-(2-hydroxyethyl)cyclohexane-1-carboxamide.
What is the SMILES notation for 1-(3-fluorophenyl)-N-(2-hydroxyethyl)cyclohexane-1-carboxamide?
The canonical SMILES for 1-(3-fluorophenyl)-N-(2-hydroxyethyl)cyclohexane-1-carboxamide is O=C(NCCO)C1(c2cccc(F)c2)CCCCC1.
What is the InChIKey of 1-(3-fluorophenyl)-N-(2-hydroxyethyl)cyclohexane-1-carboxamide?
The InChIKey is ZTIPWFJYGCMWSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20FNO2/c16-13-6-4-5-12(11-13)15(7-2-1-3-8-15)14(19)17-9-10-18/h4-6,11,18H,1-3,7-10H2,(H,17,19).
What are the key properties of 1-(3-fluorophenyl)-N-(2-hydroxyethyl)cyclohexane-1-carboxamide?
1-(3-fluorophenyl)-N-(2-hydroxyethyl)cyclohexane-1-carboxamide has a molecular weight of 265.33 g/mol, XLogP of 2.14, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluorophenyl)-N-(2-hydroxyethyl)cyclohexane-1-carboxamide is sourced from PubChem (CID 110904346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).