N-(4-ethyl-3-methyl-1,2-oxazol-5-yl)-1-(2-fluorophenyl)cyclopropane-1-carboxamide

C16H17FN2O2 — CID 134706373

IUPACN-(4-ethyl-3-methyl-1,2-oxazol-5-yl)-1-(2-fluorophenyl)cyclopropane-1-carboxamide
SMILESCCc1c(C)noc1NC(=O)C1(c2ccccc2F)CC1
InChIInChI=1S/C16H17FN2O2/c1-3-11-10(2)19-21-14(11)18-15(20)16(8-9-16)12-6-4-5-7-13(12)17/h4-7H,3,8-9H2,1-2H3,(H,18,20)
InChIKeyQPUFOZPESWCCOG-UHFFFAOYSA-N
MW288.32 g/mol
LogP3.35
Rot. Bonds4

About N-(4-ethyl-3-methyl-1,2-oxazol-5-yl)-1-(2-fluorophenyl)cyclopropane-1-carboxamide

N-(4-ethyl-3-methyl-1,2-oxazol-5-yl)-1-(2-fluorophenyl)cyclopropane-1-carboxamide (PubChem CID 134706373) has the molecular formula C16H17FN2O2 and a molecular weight of 288.32 g/mol. Its IUPAC name is N-(4-ethyl-3-methyl-1,2-oxazol-5-yl)-1-(2-fluorophenyl)cyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-(4-ethyl-3-methyl-1,2-oxazol-5-yl)-1-(2-fluorophenyl)cyclopropane-1-carboxamide
PubChem CID134706373
Molecular FormulaC16H17FN2O2
Molecular Weight288.32 g/mol
Exact Mass288.13
IUPAC NameN-(4-ethyl-3-methyl-1,2-oxazol-5-yl)-1-(2-fluorophenyl)cyclopropane-1-carboxamide
SMILESCCc1c(C)noc1NC(=O)C1(c2ccccc2F)CC1
InChIInChI=1S/C16H17FN2O2/c1-3-11-10(2)19-21-14(11)18-15(20)16(8-9-16)12-6-4-5-7-13(12)17/h4-7H,3,8-9H2,1-2H3,(H,18,20)
InChIKeyQPUFOZPESWCCOG-UHFFFAOYSA-N
XLogP3.35
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.32
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-ethyl-3-methyl-1,2-oxazol-5-yl)-1-(2-fluorophenyl)cyclopropane-1-carboxamide?
The IUPAC name of N-(4-ethyl-3-methyl-1,2-oxazol-5-yl)-1-(2-fluorophenyl)cyclopropane-1-carboxamide (CID 134706373) is N-(4-ethyl-3-methyl-1,2-oxazol-5-yl)-1-(2-fluorophenyl)cyclopropane-1-carboxamide.
What is the SMILES notation for N-(4-ethyl-3-methyl-1,2-oxazol-5-yl)-1-(2-fluorophenyl)cyclopropane-1-carboxamide?
The canonical SMILES for N-(4-ethyl-3-methyl-1,2-oxazol-5-yl)-1-(2-fluorophenyl)cyclopropane-1-carboxamide is CCc1c(C)noc1NC(=O)C1(c2ccccc2F)CC1.
What is the InChIKey of N-(4-ethyl-3-methyl-1,2-oxazol-5-yl)-1-(2-fluorophenyl)cyclopropane-1-carboxamide?
The InChIKey is QPUFOZPESWCCOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FN2O2/c1-3-11-10(2)19-21-14(11)18-15(20)16(8-9-16)12-6-4-5-7-13(12)17/h4-7H,3,8-9H2,1-2H3,(H,18,20).
What are the key properties of N-(4-ethyl-3-methyl-1,2-oxazol-5-yl)-1-(2-fluorophenyl)cyclopropane-1-carboxamide?
N-(4-ethyl-3-methyl-1,2-oxazol-5-yl)-1-(2-fluorophenyl)cyclopropane-1-carboxamide has a molecular weight of 288.32 g/mol, XLogP of 3.35, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethyl-3-methyl-1,2-oxazol-5-yl)-1-(2-fluorophenyl)cyclopropane-1-carboxamide is sourced from PubChem (CID 134706373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).