N-(2-hydroxyethyl)-3-methyl-N-(2,2,2-trifluoroethyl)furan-2-carboxamide

C10H12F3NO3 — CID 103857428

IUPACN-(2-hydroxyethyl)-3-methyl-N-(2,2,2-trifluoroethyl)furan-2-carboxamide
SMILESCc1ccoc1C(=O)N(CCO)CC(F)(F)F
InChIInChI=1S/C10H12F3NO3/c1-7-2-5-17-8(7)9(16)14(3-4-15)6-10(11,12)13/h2,5,15H,3-4,6H2,1H3
InChIKeyZGCXOSLXOIZGPM-UHFFFAOYSA-N
MW251.20 g/mol
LogP1.58
Rot. Bonds4

About N-(2-hydroxyethyl)-3-methyl-N-(2,2,2-trifluoroethyl)furan-2-carboxamide

N-(2-hydroxyethyl)-3-methyl-N-(2,2,2-trifluoroethyl)furan-2-carboxamide (PubChem CID 103857428) has the molecular formula C10H12F3NO3 and a molecular weight of 251.20 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-3-methyl-N-(2,2,2-trifluoroethyl)furan-2-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-3-methyl-N-(2,2,2-trifluoroethyl)furan-2-carboxamide
PubChem CID103857428
Molecular FormulaC10H12F3NO3
Molecular Weight251.20 g/mol
Exact Mass251.08
IUPAC NameN-(2-hydroxyethyl)-3-methyl-N-(2,2,2-trifluoroethyl)furan-2-carboxamide
SMILESCc1ccoc1C(=O)N(CCO)CC(F)(F)F
InChIInChI=1S/C10H12F3NO3/c1-7-2-5-17-8(7)9(16)14(3-4-15)6-10(11,12)13/h2,5,15H,3-4,6H2,1H3
InChIKeyZGCXOSLXOIZGPM-UHFFFAOYSA-N
XLogP1.58
TPSA53.68 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.20
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-(2-hydroxyethyl)-6-methyl-N-(2,2,2-trifluoroethyl)benzamide
CID 61113881
N-(2-bromoethyl)-N-(2,2-difluoroethyl)-3-methylfuran-2-carboxamide
CID 107491528
4-butyl-N-(2-hydroxyethyl)-N-(2,2,2-trifluoroethyl)benzamide
CID 103915592
4-amino-N-(2-hydroxyethyl)-N-(2,2,2-trifluoroethyl)benzamide
CID 54904763
N-(3-hydroxypropyl)-3-methyl-N-propan-2-ylfuran-2-carboxamide
CID 61038775
N-(2-cyanoethyl)-N-ethyl-3-methylfuran-2-carboxamide
CID 55208450
N-(2-hydroxyethyl)-6-methyl-4-oxo-N-(2,2,2-trifluoroethyl)-1H-pyridine-3-carboxamide
CID 103915507
N-(2-hydroxyethyl)-3-methyl-4-nitro-N-(2,2,2-trifluoroethyl)benzamide
CID 103857285
N-(2-hydroxyethyl)-2-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazole-4-carboxamide
CID 103915350
2-(dimethylamino)-N-(2-hydroxyethyl)-N-(2,2,2-trifluoroethyl)pyridine-4-carboxamide
CID 103857495
N-(2,2-difluoro-3-hydroxypropyl)-3-methylfuran-2-carboxamide
CID 104858004
4-carbamothioyl-N-(2-hydroxyethyl)-N-(2,2,2-trifluoroethyl)benzamide
CID 107479787

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-3-methyl-N-(2,2,2-trifluoroethyl)furan-2-carboxamide?
The IUPAC name of N-(2-hydroxyethyl)-3-methyl-N-(2,2,2-trifluoroethyl)furan-2-carboxamide (CID 103857428) is N-(2-hydroxyethyl)-3-methyl-N-(2,2,2-trifluoroethyl)furan-2-carboxamide.
What is the SMILES notation for N-(2-hydroxyethyl)-3-methyl-N-(2,2,2-trifluoroethyl)furan-2-carboxamide?
The canonical SMILES for N-(2-hydroxyethyl)-3-methyl-N-(2,2,2-trifluoroethyl)furan-2-carboxamide is Cc1ccoc1C(=O)N(CCO)CC(F)(F)F.
What is the InChIKey of N-(2-hydroxyethyl)-3-methyl-N-(2,2,2-trifluoroethyl)furan-2-carboxamide?
The InChIKey is ZGCXOSLXOIZGPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12F3NO3/c1-7-2-5-17-8(7)9(16)14(3-4-15)6-10(11,12)13/h2,5,15H,3-4,6H2,1H3.
What are the key properties of N-(2-hydroxyethyl)-3-methyl-N-(2,2,2-trifluoroethyl)furan-2-carboxamide?
N-(2-hydroxyethyl)-3-methyl-N-(2,2,2-trifluoroethyl)furan-2-carboxamide has a molecular weight of 251.20 g/mol, XLogP of 1.58, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-3-methyl-N-(2,2,2-trifluoroethyl)furan-2-carboxamide is sourced from PubChem (CID 103857428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).