N-(cyclohexen-1-yl)-N-cyclopropyl-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]acetamide

C15H24F2N2O2 — CID 107485499

IUPACN-(cyclohexen-1-yl)-N-cyclopropyl-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]acetamide
SMILESO=C(CN(CCO)CC(F)F)N(C1=CCCCC1)C1CC1
InChIInChI=1S/C15H24F2N2O2/c16-14(17)10-18(8-9-20)11-15(21)19(13-6-7-13)12-4-2-1-3-5-12/h4,13-14,20H,1-3,5-11H2
InChIKeyLQZGIWKTJZYMOF-UHFFFAOYSA-N
MW302.37 g/mol
LogP1.99
Rot. Bonds8

About N-(cyclohexen-1-yl)-N-cyclopropyl-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]acetamide

N-(cyclohexen-1-yl)-N-cyclopropyl-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]acetamide (PubChem CID 107485499) has the molecular formula C15H24F2N2O2 and a molecular weight of 302.37 g/mol. Its IUPAC name is N-(cyclohexen-1-yl)-N-cyclopropyl-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]acetamide.

Molecular Properties

Compound NameN-(cyclohexen-1-yl)-N-cyclopropyl-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]acetamide
PubChem CID107485499
Molecular FormulaC15H24F2N2O2
Molecular Weight302.37 g/mol
Exact Mass302.18
IUPAC NameN-(cyclohexen-1-yl)-N-cyclopropyl-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]acetamide
SMILESO=C(CN(CCO)CC(F)F)N(C1=CCCCC1)C1CC1
InChIInChI=1S/C15H24F2N2O2/c16-14(17)10-18(8-9-20)11-15(21)19(13-6-7-13)12-4-2-1-3-5-12/h4,13-14,20H,1-3,5-11H2
InChIKeyLQZGIWKTJZYMOF-UHFFFAOYSA-N
XLogP1.99
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.37
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(cyclohexen-1-yl)-N-cyclopropyl-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]acetamide?
The IUPAC name of N-(cyclohexen-1-yl)-N-cyclopropyl-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]acetamide (CID 107485499) is N-(cyclohexen-1-yl)-N-cyclopropyl-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]acetamide.
What is the SMILES notation for N-(cyclohexen-1-yl)-N-cyclopropyl-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]acetamide?
The canonical SMILES for N-(cyclohexen-1-yl)-N-cyclopropyl-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]acetamide is O=C(CN(CCO)CC(F)F)N(C1=CCCCC1)C1CC1.
What is the InChIKey of N-(cyclohexen-1-yl)-N-cyclopropyl-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]acetamide?
The InChIKey is LQZGIWKTJZYMOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24F2N2O2/c16-14(17)10-18(8-9-20)11-15(21)19(13-6-7-13)12-4-2-1-3-5-12/h4,13-14,20H,1-3,5-11H2.
What are the key properties of N-(cyclohexen-1-yl)-N-cyclopropyl-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]acetamide?
N-(cyclohexen-1-yl)-N-cyclopropyl-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]acetamide has a molecular weight of 302.37 g/mol, XLogP of 1.99, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexen-1-yl)-N-cyclopropyl-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]acetamide is sourced from PubChem (CID 107485499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).