(5-naphthalen-2-yl-1,2-oxazol-3-yl)methanamine

C14H12N2O — CID 54846604

IUPAC(5-naphthalen-2-yl-1,2-oxazol-3-yl)methanamine
SMILESNCc1cc(-c2ccc3ccccc3c2)on1
InChIInChI=1S/C14H12N2O/c15-9-13-8-14(17-16-13)12-6-5-10-3-1-2-4-11(10)7-12/h1-8H,9,15H2
InChIKeyQFWPFRVYYPVNQC-UHFFFAOYSA-N
MW224.26 g/mol
LogP2.95
Rot. Bonds2

About (5-naphthalen-2-yl-1,2-oxazol-3-yl)methanamine

(5-naphthalen-2-yl-1,2-oxazol-3-yl)methanamine (PubChem CID 54846604) has the molecular formula C14H12N2O and a molecular weight of 224.26 g/mol. Its IUPAC name is (5-naphthalen-2-yl-1,2-oxazol-3-yl)methanamine.

Molecular Properties

Compound Name(5-naphthalen-2-yl-1,2-oxazol-3-yl)methanamine
PubChem CID54846604
Molecular FormulaC14H12N2O
Molecular Weight224.26 g/mol
Exact Mass224.09
IUPAC Name(5-naphthalen-2-yl-1,2-oxazol-3-yl)methanamine
SMILESNCc1cc(-c2ccc3ccccc3c2)on1
InChIInChI=1S/C14H12N2O/c15-9-13-8-14(17-16-13)12-6-5-10-3-1-2-4-11(10)7-12/h1-8H,9,15H2
InChIKeyQFWPFRVYYPVNQC-UHFFFAOYSA-N
XLogP2.95
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,2-oxazol-3-yl]methanamine
CID 28808405
[5-(3-methoxyphenyl)-1,2-oxazol-3-yl]methanamine;hydrochloride
CID 50998515
(5-pyridin-4-yl-1,2-oxazol-3-yl)methanamine
CID 23006269
[2-[(5-naphthalen-2-yl-1,2-oxazol-3-yl)methyl]-8-oxa-2-azaspiro[4.5]decan-4-yl]methanamine
CID 167844251
4-tert-butyl-N-[(5-naphthalen-2-yl-1,2-oxazol-3-yl)methyl]benzamide
CID 16867364
N-[(5-naphthalen-2-yl-1,2-oxazol-3-yl)methyl]-2-phenoxypropanamide
CID 16867418
[5-(4-cyclopentyloxyphenyl)-1,2-oxazol-3-yl]methanamine
CID 82483490
3,4,5-trimethoxy-N-[(5-naphthalen-2-yl-1,2-oxazol-3-yl)methyl]benzamide
CID 16867378
3-[[4-[2-(2-methylphenoxy)ethyl]piperazin-1-yl]methyl]-5-naphthalen-2-yl-1,2-oxazole
CID 166338022
azocan-1-yl-(5-naphthalen-2-yl-1,2-oxazol-3-yl)methanone
CID 46087244
1-(2-naphthalen-2-yl-1,3-thiazol-4-yl)propan-2-amine
CID 116888207
[5-(furan-2-yl)-1,2-oxazol-3-yl]methanamine
CID 7060533

Frequently Asked Questions

What is the IUPAC name of (5-naphthalen-2-yl-1,2-oxazol-3-yl)methanamine?
The IUPAC name of (5-naphthalen-2-yl-1,2-oxazol-3-yl)methanamine (CID 54846604) is (5-naphthalen-2-yl-1,2-oxazol-3-yl)methanamine.
What is the SMILES notation for (5-naphthalen-2-yl-1,2-oxazol-3-yl)methanamine?
The canonical SMILES for (5-naphthalen-2-yl-1,2-oxazol-3-yl)methanamine is NCc1cc(-c2ccc3ccccc3c2)on1.
What is the InChIKey of (5-naphthalen-2-yl-1,2-oxazol-3-yl)methanamine?
The InChIKey is QFWPFRVYYPVNQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2O/c15-9-13-8-14(17-16-13)12-6-5-10-3-1-2-4-11(10)7-12/h1-8H,9,15H2.
What are the key properties of (5-naphthalen-2-yl-1,2-oxazol-3-yl)methanamine?
(5-naphthalen-2-yl-1,2-oxazol-3-yl)methanamine has a molecular weight of 224.26 g/mol, XLogP of 2.95, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-naphthalen-2-yl-1,2-oxazol-3-yl)methanamine is sourced from PubChem (CID 54846604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).