N-(2-hydroxyethyl)-2-(tetrazol-1-yl)-N-(2,2,2-trifluoroethyl)acetamide

C7H10F3N5O2 — CID 103857360

IUPACN-(2-hydroxyethyl)-2-(tetrazol-1-yl)-N-(2,2,2-trifluoroethyl)acetamide
SMILESO=C(Cn1cnnn1)N(CCO)CC(F)(F)F
InChIInChI=1S/C7H10F3N5O2/c8-7(9,10)4-14(1-2-16)6(17)3-15-5-11-12-13-15/h5,16H,1-4H2
InChIKeyVAZIZOPIXALBMJ-UHFFFAOYSA-N
MW253.18 g/mol
LogP-0.94
Rot. Bonds5

About N-(2-hydroxyethyl)-2-(tetrazol-1-yl)-N-(2,2,2-trifluoroethyl)acetamide

N-(2-hydroxyethyl)-2-(tetrazol-1-yl)-N-(2,2,2-trifluoroethyl)acetamide (PubChem CID 103857360) has the molecular formula C7H10F3N5O2 and a molecular weight of 253.18 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-2-(tetrazol-1-yl)-N-(2,2,2-trifluoroethyl)acetamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-2-(tetrazol-1-yl)-N-(2,2,2-trifluoroethyl)acetamide
PubChem CID103857360
Molecular FormulaC7H10F3N5O2
Molecular Weight253.18 g/mol
Exact Mass253.08
IUPAC NameN-(2-hydroxyethyl)-2-(tetrazol-1-yl)-N-(2,2,2-trifluoroethyl)acetamide
SMILESO=C(Cn1cnnn1)N(CCO)CC(F)(F)F
InChIInChI=1S/C7H10F3N5O2/c8-7(9,10)4-14(1-2-16)6(17)3-15-5-11-12-13-15/h5,16H,1-4H2
InChIKeyVAZIZOPIXALBMJ-UHFFFAOYSA-N
XLogP-0.94
TPSA84.14 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.18
LogP ≤ 5-0.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-2-(tetrazol-1-yl)-N-(2,2,2-trifluoroethyl)acetamide?
The IUPAC name of N-(2-hydroxyethyl)-2-(tetrazol-1-yl)-N-(2,2,2-trifluoroethyl)acetamide (CID 103857360) is N-(2-hydroxyethyl)-2-(tetrazol-1-yl)-N-(2,2,2-trifluoroethyl)acetamide.
What is the SMILES notation for N-(2-hydroxyethyl)-2-(tetrazol-1-yl)-N-(2,2,2-trifluoroethyl)acetamide?
The canonical SMILES for N-(2-hydroxyethyl)-2-(tetrazol-1-yl)-N-(2,2,2-trifluoroethyl)acetamide is O=C(Cn1cnnn1)N(CCO)CC(F)(F)F.
What is the InChIKey of N-(2-hydroxyethyl)-2-(tetrazol-1-yl)-N-(2,2,2-trifluoroethyl)acetamide?
The InChIKey is VAZIZOPIXALBMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10F3N5O2/c8-7(9,10)4-14(1-2-16)6(17)3-15-5-11-12-13-15/h5,16H,1-4H2.
What are the key properties of N-(2-hydroxyethyl)-2-(tetrazol-1-yl)-N-(2,2,2-trifluoroethyl)acetamide?
N-(2-hydroxyethyl)-2-(tetrazol-1-yl)-N-(2,2,2-trifluoroethyl)acetamide has a molecular weight of 253.18 g/mol, XLogP of -0.94, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-2-(tetrazol-1-yl)-N-(2,2,2-trifluoroethyl)acetamide is sourced from PubChem (CID 103857360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).