2-[cyclohexyl(2-hydroxyethyl)amino]-N-[2-(2,6-difluorophenyl)ethyl]acetamide

C18H26F2N2O2 — CID 111114280

IUPAC2-[cyclohexyl(2-hydroxyethyl)amino]-N-[2-(2,6-difluorophenyl)ethyl]acetamide
SMILESO=C(CN(CCO)C1CCCCC1)NCCc1c(F)cccc1F
InChIInChI=1S/C18H26F2N2O2/c19-16-7-4-8-17(20)15(16)9-10-21-18(24)13-22(11-12-23)14-5-2-1-3-6-14/h4,7-8,14,23H,1-3,5-6,9-13H2,(H,21,24)
InChIKeyDQDLTHPSCHOTGT-UHFFFAOYSA-N
MW340.41 g/mol
LogP2.25
Rot. Bonds8

About 2-[cyclohexyl(2-hydroxyethyl)amino]-N-[2-(2,6-difluorophenyl)ethyl]acetamide

2-[cyclohexyl(2-hydroxyethyl)amino]-N-[2-(2,6-difluorophenyl)ethyl]acetamide (PubChem CID 111114280) has the molecular formula C18H26F2N2O2 and a molecular weight of 340.41 g/mol. Its IUPAC name is 2-[cyclohexyl(2-hydroxyethyl)amino]-N-[2-(2,6-difluorophenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-[cyclohexyl(2-hydroxyethyl)amino]-N-[2-(2,6-difluorophenyl)ethyl]acetamide
PubChem CID111114280
Molecular FormulaC18H26F2N2O2
Molecular Weight340.41 g/mol
Exact Mass340.20
IUPAC Name2-[cyclohexyl(2-hydroxyethyl)amino]-N-[2-(2,6-difluorophenyl)ethyl]acetamide
SMILESO=C(CN(CCO)C1CCCCC1)NCCc1c(F)cccc1F
InChIInChI=1S/C18H26F2N2O2/c19-16-7-4-8-17(20)15(16)9-10-21-18(24)13-22(11-12-23)14-5-2-1-3-6-14/h4,7-8,14,23H,1-3,5-6,9-13H2,(H,21,24)
InChIKeyDQDLTHPSCHOTGT-UHFFFAOYSA-N
XLogP2.25
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.41
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[cyclohexyl(2-hydroxyethyl)amino]-N-[2-(2,6-difluorophenyl)ethyl]acetamide?
The IUPAC name of 2-[cyclohexyl(2-hydroxyethyl)amino]-N-[2-(2,6-difluorophenyl)ethyl]acetamide (CID 111114280) is 2-[cyclohexyl(2-hydroxyethyl)amino]-N-[2-(2,6-difluorophenyl)ethyl]acetamide.
What is the SMILES notation for 2-[cyclohexyl(2-hydroxyethyl)amino]-N-[2-(2,6-difluorophenyl)ethyl]acetamide?
The canonical SMILES for 2-[cyclohexyl(2-hydroxyethyl)amino]-N-[2-(2,6-difluorophenyl)ethyl]acetamide is O=C(CN(CCO)C1CCCCC1)NCCc1c(F)cccc1F.
What is the InChIKey of 2-[cyclohexyl(2-hydroxyethyl)amino]-N-[2-(2,6-difluorophenyl)ethyl]acetamide?
The InChIKey is DQDLTHPSCHOTGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26F2N2O2/c19-16-7-4-8-17(20)15(16)9-10-21-18(24)13-22(11-12-23)14-5-2-1-3-6-14/h4,7-8,14,23H,1-3,5-6,9-13H2,(H,21,24).
What are the key properties of 2-[cyclohexyl(2-hydroxyethyl)amino]-N-[2-(2,6-difluorophenyl)ethyl]acetamide?
2-[cyclohexyl(2-hydroxyethyl)amino]-N-[2-(2,6-difluorophenyl)ethyl]acetamide has a molecular weight of 340.41 g/mol, XLogP of 2.25, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclohexyl(2-hydroxyethyl)amino]-N-[2-(2,6-difluorophenyl)ethyl]acetamide is sourced from PubChem (CID 111114280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).