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

C12H14N2O2 — CID 82079249

IUPAC[5-(2-methoxyphenyl)-4-methyl-1,3-oxazol-2-yl]methanamine
SMILESCOc1ccccc1-c1oc(CN)nc1C
InChIInChI=1S/C12H14N2O2/c1-8-12(16-11(7-13)14-8)9-5-3-4-6-10(9)15-2/h3-6H,7,13H2,1-2H3
InChIKeyBLNJNTGIOYUXLK-UHFFFAOYSA-N
MW218.26 g/mol
LogP2.12
Rot. Bonds3

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

[5-(2-methoxyphenyl)-4-methyl-1,3-oxazol-2-yl]methanamine (PubChem CID 82079249) has the molecular formula C12H14N2O2 and a molecular weight of 218.26 g/mol. Its IUPAC name is [5-(2-methoxyphenyl)-4-methyl-1,3-oxazol-2-yl]methanamine.

Molecular Properties

Compound Name[5-(2-methoxyphenyl)-4-methyl-1,3-oxazol-2-yl]methanamine
PubChem CID82079249
Molecular FormulaC12H14N2O2
Molecular Weight218.26 g/mol
Exact Mass218.11
IUPAC Name[5-(2-methoxyphenyl)-4-methyl-1,3-oxazol-2-yl]methanamine
SMILESCOc1ccccc1-c1oc(CN)nc1C
InChIInChI=1S/C12H14N2O2/c1-8-12(16-11(7-13)14-8)9-5-3-4-6-10(9)15-2/h3-6H,7,13H2,1-2H3
InChIKeyBLNJNTGIOYUXLK-UHFFFAOYSA-N
XLogP2.12
TPSA61.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[5-(2-methoxyphenyl)-4-methyl-1,3-oxazol-2-yl]methanol
CID 105473690
[5-(2-methoxy-4,5-dimethylphenyl)-4-methyl-1,3-oxazol-2-yl]methanamine
CID 82086154
[5-(2,5-dimethylphenyl)-4-methyl-1,3-oxazol-2-yl]methanamine
CID 82078799
[5-(2-methoxyphenyl)-1,2,4-oxadiazol-3-yl]methanamine
CID 16767461
N'-[2-(2-methoxyphenyl)-4,6-dimethylpyrimidin-5-yl]ethane-1,2-diamine
CID 117212505
[5-(2-methoxyphenyl)-1-methyl-1,2,4-triazol-3-yl]methanamine
CID 82472126
2-[4-(2-methoxyphenyl)-1,3-oxazol-2-yl]ethanamine
CID 82285403
2-[5-(2-methoxyphenyl)-1,2-oxazol-4-yl]ethanamine
CID 82285402
5-(2-methoxyphenyl)-3-methyl-1,2-oxazole-4-carbaldehyde
CID 82127138
[3-(2-bromo-3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methanamine
CID 117456713
[3-(2-chloro-3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methanamine
CID 117351733
[3-(2,3-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methanamine;hydrochloride
CID 86261810

Frequently Asked Questions

What is the IUPAC name of [5-(2-methoxyphenyl)-4-methyl-1,3-oxazol-2-yl]methanamine?
The IUPAC name of [5-(2-methoxyphenyl)-4-methyl-1,3-oxazol-2-yl]methanamine (CID 82079249) is [5-(2-methoxyphenyl)-4-methyl-1,3-oxazol-2-yl]methanamine.
What is the SMILES notation for [5-(2-methoxyphenyl)-4-methyl-1,3-oxazol-2-yl]methanamine?
The canonical SMILES for [5-(2-methoxyphenyl)-4-methyl-1,3-oxazol-2-yl]methanamine is COc1ccccc1-c1oc(CN)nc1C.
What is the InChIKey of [5-(2-methoxyphenyl)-4-methyl-1,3-oxazol-2-yl]methanamine?
The InChIKey is BLNJNTGIOYUXLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O2/c1-8-12(16-11(7-13)14-8)9-5-3-4-6-10(9)15-2/h3-6H,7,13H2,1-2H3.
What are the key properties of [5-(2-methoxyphenyl)-4-methyl-1,3-oxazol-2-yl]methanamine?
[5-(2-methoxyphenyl)-4-methyl-1,3-oxazol-2-yl]methanamine has a molecular weight of 218.26 g/mol, XLogP of 2.12, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(2-methoxyphenyl)-4-methyl-1,3-oxazol-2-yl]methanamine is sourced from PubChem (CID 82079249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).