ethyl N-[1-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]ethyl]carbamate

C14H15FN2O3 — CID 110660779

IUPACethyl N-[1-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]ethyl]carbamate
SMILESCCOC(=O)NC(C)c1ncc(-c2ccc(F)cc2)o1
InChIInChI=1S/C14H15FN2O3/c1-3-19-14(18)17-9(2)13-16-8-12(20-13)10-4-6-11(15)7-5-10/h4-9H,3H2,1-2H3,(H,17,18)
InChIKeyHLOFBGINPZIHFS-UHFFFAOYSA-N
MW278.28 g/mol
LogP3.29
Rot. Bonds4

About ethyl N-[1-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]ethyl]carbamate

ethyl N-[1-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]ethyl]carbamate (PubChem CID 110660779) has the molecular formula C14H15FN2O3 and a molecular weight of 278.28 g/mol. Its IUPAC name is ethyl N-[1-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]ethyl]carbamate.

Molecular Properties

Compound Nameethyl N-[1-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]ethyl]carbamate
PubChem CID110660779
Molecular FormulaC14H15FN2O3
Molecular Weight278.28 g/mol
Exact Mass278.11
IUPAC Nameethyl N-[1-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]ethyl]carbamate
SMILESCCOC(=O)NC(C)c1ncc(-c2ccc(F)cc2)o1
InChIInChI=1S/C14H15FN2O3/c1-3-19-14(18)17-9(2)13-16-8-12(20-13)10-4-6-11(15)7-5-10/h4-9H,3H2,1-2H3,(H,17,18)
InChIKeyHLOFBGINPZIHFS-UHFFFAOYSA-N
XLogP3.29
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.28
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]ethyl]cyclobutanecarboxamide
CID 110660785
2-(3-fluorophenoxy)-N-[1-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]ethyl]acetamide
CID 110660794
N-[1-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]ethyl]-2,3-dihydro-1H-isoindole-5-carboxamide
CID 167826059
N-[1-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]ethyl]imidazo[1,5-a]pyridine-3-carboxamide
CID 167923624
2-amino-2-methyl-N-[1-(5-phenyl-1,3-oxazol-2-yl)ethyl]pentanamide;hydrochloride
CID 119799047
N-[1-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]ethyl]-2,3,4,5-tetrahydro-1H-2-benzazepine-7-carboxamide
CID 166295531
methyl 2-[[5-(4-fluorophenyl)-1,3-oxazol-2-yl]sulfanyl]propanoate
CID 75866644
4-amino-N-[1-(5-phenyl-1,3-oxazol-2-yl)ethyl]butanamide
CID 119332446
ethyl N-[1-(2,4-difluorophenyl)ethyl]carbamate
CID 60638339
4-amino-3-methoxy-N-[1-(5-phenyl-1,3-oxazol-2-yl)ethyl]butanamide;hydrochloride
CID 120593061
N-[1-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]ethyl]-3-methylbenzenesulfonamide
CID 110660806
7-amino-N-[1-(5-phenyl-1,3-oxazol-2-yl)ethyl]heptanamide
CID 119799002

Frequently Asked Questions

What is the IUPAC name of ethyl N-[1-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]ethyl]carbamate?
The IUPAC name of ethyl N-[1-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]ethyl]carbamate (CID 110660779) is ethyl N-[1-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]ethyl]carbamate.
What is the SMILES notation for ethyl N-[1-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]ethyl]carbamate?
The canonical SMILES for ethyl N-[1-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]ethyl]carbamate is CCOC(=O)NC(C)c1ncc(-c2ccc(F)cc2)o1.
What is the InChIKey of ethyl N-[1-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]ethyl]carbamate?
The InChIKey is HLOFBGINPZIHFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FN2O3/c1-3-19-14(18)17-9(2)13-16-8-12(20-13)10-4-6-11(15)7-5-10/h4-9H,3H2,1-2H3,(H,17,18).
What are the key properties of ethyl N-[1-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]ethyl]carbamate?
ethyl N-[1-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]ethyl]carbamate has a molecular weight of 278.28 g/mol, XLogP of 3.29, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-[1-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]ethyl]carbamate is sourced from PubChem (CID 110660779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).