[4-(3-amino-1,2-oxazol-5-yl)phenyl] carbamate

C10H9N3O3 — CID 175331108

IUPAC[4-(3-amino-1,2-oxazol-5-yl)phenyl] carbamate
SMILESNC(=O)Oc1ccc(-c2cc(N)no2)cc1
InChIInChI=1S/C10H9N3O3/c11-9-5-8(16-13-9)6-1-3-7(4-2-6)15-10(12)14/h1-5H,(H2,11,13)(H2,12,14)
InChIKeyRVUXXZWLIXQBKL-UHFFFAOYSA-N
MW219.20 g/mol
LogP1.38
Rot. Bonds2

About [4-(3-amino-1,2-oxazol-5-yl)phenyl] carbamate

[4-(3-amino-1,2-oxazol-5-yl)phenyl] carbamate (PubChem CID 175331108) has the molecular formula C10H9N3O3 and a molecular weight of 219.20 g/mol. Its IUPAC name is [4-(3-amino-1,2-oxazol-5-yl)phenyl] carbamate.

Molecular Properties

Compound Name[4-(3-amino-1,2-oxazol-5-yl)phenyl] carbamate
PubChem CID175331108
Molecular FormulaC10H9N3O3
Molecular Weight219.20 g/mol
Exact Mass219.06
IUPAC Name[4-(3-amino-1,2-oxazol-5-yl)phenyl] carbamate
SMILESNC(=O)Oc1ccc(-c2cc(N)no2)cc1
InChIInChI=1S/C10H9N3O3/c11-9-5-8(16-13-9)6-1-3-7(4-2-6)15-10(12)14/h1-5H,(H2,11,13)(H2,12,14)
InChIKeyRVUXXZWLIXQBKL-UHFFFAOYSA-N
XLogP1.38
TPSA104.37 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.20
LogP ≤ 51.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-(4-propan-2-yloxyphenyl)-1,2-oxazol-3-amine
CID 82472063
5-(4-ethoxyphenyl)-1,2-oxazol-3-amine
CID 27242742
5-[4-(1,1-dioxothietan-3-yl)oxyphenyl]-1,2-oxazol-3-amine
CID 117449852
5-[4-(oxan-4-yloxy)phenyl]-1,2-oxazol-3-amine
CID 117404768
ethane;5-phenyl-1,2-oxazol-3-amine
CID 145311661
[4-(4-bromophenyl)phenyl] carbamate
CID 151826430
[4-(5-phenyl-1,2-oxazol-3-yl)phenyl] benzoate
CID 144750288
5-[4-(triazol-2-yl)phenyl]-1,2-oxazol-3-amine
CID 117326392
5-[4-(difluoromethylsulfanyl)phenyl]-1,2-oxazol-3-amine
CID 117357259
1-[3-(3-amino-1,2-oxazol-5-yl)phenyl]-1-methylurea
CID 117336131
5-[3-(difluoromethoxy)phenyl]-1,2-oxazol-3-amine
CID 66199211
5-[4-(1,3-oxazol-2-yl)phenyl]-1,2-oxazol-3-amine
CID 117326354

Frequently Asked Questions

What is the IUPAC name of [4-(3-amino-1,2-oxazol-5-yl)phenyl] carbamate?
The IUPAC name of [4-(3-amino-1,2-oxazol-5-yl)phenyl] carbamate (CID 175331108) is [4-(3-amino-1,2-oxazol-5-yl)phenyl] carbamate.
What is the SMILES notation for [4-(3-amino-1,2-oxazol-5-yl)phenyl] carbamate?
The canonical SMILES for [4-(3-amino-1,2-oxazol-5-yl)phenyl] carbamate is NC(=O)Oc1ccc(-c2cc(N)no2)cc1.
What is the InChIKey of [4-(3-amino-1,2-oxazol-5-yl)phenyl] carbamate?
The InChIKey is RVUXXZWLIXQBKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N3O3/c11-9-5-8(16-13-9)6-1-3-7(4-2-6)15-10(12)14/h1-5H,(H2,11,13)(H2,12,14).
What are the key properties of [4-(3-amino-1,2-oxazol-5-yl)phenyl] carbamate?
[4-(3-amino-1,2-oxazol-5-yl)phenyl] carbamate has a molecular weight of 219.20 g/mol, XLogP of 1.38, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(3-amino-1,2-oxazol-5-yl)phenyl] carbamate is sourced from PubChem (CID 175331108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).