N-(2-hydroxyethyl)-2,2,3,3-tetramethyl-N-(2,2,2-trifluoroethyl)cyclopropane-1-carboxamide

C12H20F3NO2 — CID 103915547

IUPACN-(2-hydroxyethyl)-2,2,3,3-tetramethyl-N-(2,2,2-trifluoroethyl)cyclopropane-1-carboxamide
SMILESCC1(C)C(C(=O)N(CCO)CC(F)(F)F)C1(C)C
InChIInChI=1S/C12H20F3NO2/c1-10(2)8(11(10,3)4)9(18)16(5-6-17)7-12(13,14)15/h8,17H,5-7H2,1-4H3
InChIKeyMOZCRQSBJZNWPK-UHFFFAOYSA-N
MW267.29 g/mol
LogP2.05
Rot. Bonds4

About N-(2-hydroxyethyl)-2,2,3,3-tetramethyl-N-(2,2,2-trifluoroethyl)cyclopropane-1-carboxamide

N-(2-hydroxyethyl)-2,2,3,3-tetramethyl-N-(2,2,2-trifluoroethyl)cyclopropane-1-carboxamide (PubChem CID 103915547) has the molecular formula C12H20F3NO2 and a molecular weight of 267.29 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-2,2,3,3-tetramethyl-N-(2,2,2-trifluoroethyl)cyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-2,2,3,3-tetramethyl-N-(2,2,2-trifluoroethyl)cyclopropane-1-carboxamide
PubChem CID103915547
Molecular FormulaC12H20F3NO2
Molecular Weight267.29 g/mol
Exact Mass267.14
IUPAC NameN-(2-hydroxyethyl)-2,2,3,3-tetramethyl-N-(2,2,2-trifluoroethyl)cyclopropane-1-carboxamide
SMILESCC1(C)C(C(=O)N(CCO)CC(F)(F)F)C1(C)C
InChIInChI=1S/C12H20F3NO2/c1-10(2)8(11(10,3)4)9(18)16(5-6-17)7-12(13,14)15/h8,17H,5-7H2,1-4H3
InChIKeyMOZCRQSBJZNWPK-UHFFFAOYSA-N
XLogP2.05
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.29
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-2,2,3,3-tetramethyl-N-(2,2,2-trifluoroethyl)cyclopropane-1-carboxamide?
The IUPAC name of N-(2-hydroxyethyl)-2,2,3,3-tetramethyl-N-(2,2,2-trifluoroethyl)cyclopropane-1-carboxamide (CID 103915547) is N-(2-hydroxyethyl)-2,2,3,3-tetramethyl-N-(2,2,2-trifluoroethyl)cyclopropane-1-carboxamide.
What is the SMILES notation for N-(2-hydroxyethyl)-2,2,3,3-tetramethyl-N-(2,2,2-trifluoroethyl)cyclopropane-1-carboxamide?
The canonical SMILES for N-(2-hydroxyethyl)-2,2,3,3-tetramethyl-N-(2,2,2-trifluoroethyl)cyclopropane-1-carboxamide is CC1(C)C(C(=O)N(CCO)CC(F)(F)F)C1(C)C.
What is the InChIKey of N-(2-hydroxyethyl)-2,2,3,3-tetramethyl-N-(2,2,2-trifluoroethyl)cyclopropane-1-carboxamide?
The InChIKey is MOZCRQSBJZNWPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20F3NO2/c1-10(2)8(11(10,3)4)9(18)16(5-6-17)7-12(13,14)15/h8,17H,5-7H2,1-4H3.
What are the key properties of N-(2-hydroxyethyl)-2,2,3,3-tetramethyl-N-(2,2,2-trifluoroethyl)cyclopropane-1-carboxamide?
N-(2-hydroxyethyl)-2,2,3,3-tetramethyl-N-(2,2,2-trifluoroethyl)cyclopropane-1-carboxamide has a molecular weight of 267.29 g/mol, XLogP of 2.05, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-2,2,3,3-tetramethyl-N-(2,2,2-trifluoroethyl)cyclopropane-1-carboxamide is sourced from PubChem (CID 103915547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).