1-[5-(4-methoxyphenyl)-1,2-oxazol-3-yl]methanamine

1-[5-(4-methoxyphenyl)-1,2-oxazol-3-yl]methanamine

CAS: 1018662-21-9

Formula: C11H12N2O2

SMILES: COC1=CC=C(C=C1)C1=CC(CN)=NO1

IUPAC: 1-[5-(4-methoxyphenyl)-1,2-oxazol-3-yl]methanamine

InChI: InChI=1S/C11H12N2O2/c1-14-10-4-2-8(3-5-10)11-6-9(7-12)13-15-11/h2-6H,7,12H2,1H3

Composition: C (64.69%), H (5.92%), N (13.72%), O (15.67%)

Molar Mass: 204.229

Atom Count: 27

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	204.089877634
Formal Charge	0
FSP3	0.18
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	JEVVHEACJGXPMC-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	56.93
Topological Polar Surface Area	61.28
Polarizability	23.15
Ring Count	2
Rotatable Bond Count	3

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