1-(4-fluorophenyl)-N-[2-(1H-indol-3-yl)ethyl]cyclohexane-1-carboxamide

C23H25FN2O — CID 71885829

IUPAC1-(4-fluorophenyl)-N-[2-(1H-indol-3-yl)ethyl]cyclohexane-1-carboxamide
SMILESO=C(NCCc1c[nH]c2ccccc12)C1(c2ccc(F)cc2)CCCCC1
InChIInChI=1S/C23H25FN2O/c24-19-10-8-18(9-11-19)23(13-4-1-5-14-23)22(27)25-15-12-17-16-26-21-7-3-2-6-20(17)21/h2-3,6-11,16,26H,1,4-5,12-15H2,(H,25,27)
InChIKeyAWXJZVTZKRLUDN-UHFFFAOYSA-N
MW364.46 g/mol
LogP4.87
Rot. Bonds5

About 1-(4-fluorophenyl)-N-[2-(1H-indol-3-yl)ethyl]cyclohexane-1-carboxamide

1-(4-fluorophenyl)-N-[2-(1H-indol-3-yl)ethyl]cyclohexane-1-carboxamide (PubChem CID 71885829) has the molecular formula C23H25FN2O and a molecular weight of 364.46 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-N-[2-(1H-indol-3-yl)ethyl]cyclohexane-1-carboxamide.

Molecular Properties

Compound Name1-(4-fluorophenyl)-N-[2-(1H-indol-3-yl)ethyl]cyclohexane-1-carboxamide
PubChem CID71885829
Molecular FormulaC23H25FN2O
Molecular Weight364.46 g/mol
Exact Mass364.20
IUPAC Name1-(4-fluorophenyl)-N-[2-(1H-indol-3-yl)ethyl]cyclohexane-1-carboxamide
SMILESO=C(NCCc1c[nH]c2ccccc12)C1(c2ccc(F)cc2)CCCCC1
InChIInChI=1S/C23H25FN2O/c24-19-10-8-18(9-11-19)23(13-4-1-5-14-23)22(27)25-15-12-17-16-26-21-7-3-2-6-20(17)21/h2-3,6-11,16,26H,1,4-5,12-15H2,(H,25,27)
InChIKeyAWXJZVTZKRLUDN-UHFFFAOYSA-N
XLogP4.87
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.46
LogP ≤ 54.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

1-(4-fluorophenyl)-N-[2-(1H-indol-3-yl)ethyl]cyclobutane-1-carboxamide
CID 110438229
1-(4-chlorophenyl)-N-[2-(1H-indol-3-yl)ethyl]cyclopropane-1-carboxamide
CID 2466291
1-amino-N-[2-(1H-indol-3-yl)ethyl]cyclohexane-1-carboxamide
CID 39058421
1-amino-N-[2-(1H-indol-3-yl)ethyl]cyclohexane-1-carboxamide;hydrochloride
CID 119263383
1-(3-chlorophenyl)-N-[2-(1H-indol-3-yl)ethyl]cyclopropane-1-carboxamide
CID 110438172
1-(4-fluorophenyl)-N-(4-phenylbutyl)cyclohexane-1-carboxamide
CID 58842299
1-amino-N-[3-(1H-indol-3-yl)propyl]cyclopentane-1-carboxamide
CID 119320799
2-[2-(1H-indol-3-yl)ethylcarbamoyl]cyclohexene-1-carboxylic acid
CID 53270372
N-[2-(4-fluorophenyl)ethyl]-2-[2-(1H-indol-3-yl)ethylamino]acetamide
CID 109000531
N-[2-(4-aminophenyl)ethyl]-1-(4-fluorophenyl)cyclopentane-1-carboxamide
CID 119549251
1-(3,5-difluorophenyl)-3-[2-(1H-indol-3-yl)ethyl]urea
CID 20757249
1-N-[2-(1H-indol-3-yl)ethyl]-1-N'-(3-methylbutyl)cyclopropane-1,1-dicarboxamide
CID 108978254

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-N-[2-(1H-indol-3-yl)ethyl]cyclohexane-1-carboxamide?
The IUPAC name of 1-(4-fluorophenyl)-N-[2-(1H-indol-3-yl)ethyl]cyclohexane-1-carboxamide (CID 71885829) is 1-(4-fluorophenyl)-N-[2-(1H-indol-3-yl)ethyl]cyclohexane-1-carboxamide.
What is the SMILES notation for 1-(4-fluorophenyl)-N-[2-(1H-indol-3-yl)ethyl]cyclohexane-1-carboxamide?
The canonical SMILES for 1-(4-fluorophenyl)-N-[2-(1H-indol-3-yl)ethyl]cyclohexane-1-carboxamide is O=C(NCCc1c[nH]c2ccccc12)C1(c2ccc(F)cc2)CCCCC1.
What is the InChIKey of 1-(4-fluorophenyl)-N-[2-(1H-indol-3-yl)ethyl]cyclohexane-1-carboxamide?
The InChIKey is AWXJZVTZKRLUDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25FN2O/c24-19-10-8-18(9-11-19)23(13-4-1-5-14-23)22(27)25-15-12-17-16-26-21-7-3-2-6-20(17)21/h2-3,6-11,16,26H,1,4-5,12-15H2,(H,25,27).
What are the key properties of 1-(4-fluorophenyl)-N-[2-(1H-indol-3-yl)ethyl]cyclohexane-1-carboxamide?
1-(4-fluorophenyl)-N-[2-(1H-indol-3-yl)ethyl]cyclohexane-1-carboxamide has a molecular weight of 364.46 g/mol, XLogP of 4.87, 5 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-N-[2-(1H-indol-3-yl)ethyl]cyclohexane-1-carboxamide is sourced from PubChem (CID 71885829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).