1-(2-methoxyphenyl)-N-(1,2-oxazol-5-ylmethyl)methanamine

C12H14N2O2 — CID 103605023

IUPAC1-(2-methoxyphenyl)-N-(1,2-oxazol-5-ylmethyl)methanamine
SMILESCOc1ccccc1CNCc1ccno1
InChIInChI=1S/C12H14N2O2/c1-15-12-5-3-2-4-10(12)8-13-9-11-6-7-14-16-11/h2-7,13H,8-9H2,1H3
InChIKeyJOJICYXGQVJMBI-UHFFFAOYSA-N
MW218.26 g/mol
LogP1.97
Rot. Bonds5

About 1-(2-methoxyphenyl)-N-(1,2-oxazol-5-ylmethyl)methanamine

1-(2-methoxyphenyl)-N-(1,2-oxazol-5-ylmethyl)methanamine (PubChem CID 103605023) has the molecular formula C12H14N2O2 and a molecular weight of 218.26 g/mol. Its IUPAC name is 1-(2-methoxyphenyl)-N-(1,2-oxazol-5-ylmethyl)methanamine.

Molecular Properties

Compound Name1-(2-methoxyphenyl)-N-(1,2-oxazol-5-ylmethyl)methanamine
PubChem CID103605023
Molecular FormulaC12H14N2O2
Molecular Weight218.26 g/mol
Exact Mass218.11
IUPAC Name1-(2-methoxyphenyl)-N-(1,2-oxazol-5-ylmethyl)methanamine
SMILESCOc1ccccc1CNCc1ccno1
InChIInChI=1S/C12H14N2O2/c1-15-12-5-3-2-4-10(12)8-13-9-11-6-7-14-16-11/h2-7,13H,8-9H2,1H3
InChIKeyJOJICYXGQVJMBI-UHFFFAOYSA-N
XLogP1.97
TPSA47.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2,3-dimethoxyphenyl)-N-(1,2-oxazol-5-ylmethyl)methanamine
CID 106415154
N-(1,2-oxazol-5-ylmethyl)-1-(2,3,4-trimethoxyphenyl)methanamine
CID 106415689
N-(1,2-oxazol-5-ylmethyl)-1-(2-prop-2-ynoxyphenyl)methanamine
CID 106415025
1-(1,2-oxazol-5-yl)-N-(1,2-oxazol-5-ylmethyl)methanamine
CID 165349203
1-(3-fluoro-4-methoxyphenyl)-N-(1,2-oxazol-5-ylmethyl)methanamine
CID 106415514
N-[(2,4-dimethyl-1,3-oxazol-5-yl)methyl]-1-(2-methoxyphenyl)methanamine
CID 127265972
N-[(2-methoxyphenyl)methyl]-1,2-oxazole-5-carboxamide
CID 110693577
1-(2-methoxyphenyl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]methanamine
CID 60719579
1-(4-fluorophenyl)-N-[(2-methoxyphenyl)methyl]methanamine;hydrochloride
CID 17292771
2-fluoro-6-[(1,2-oxazol-5-ylmethylamino)methyl]phenol
CID 106415448
N-[[2-(difluoromethyl)pyrazol-3-yl]methyl]-1-(2-methoxyphenyl)methanamine;hydrochloride
CID 126967408
N-[(2-methoxyphenyl)methyl]-1-[2-(trifluoromethyl)phenyl]methanamine;hydrobromide
CID 75531292

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyphenyl)-N-(1,2-oxazol-5-ylmethyl)methanamine?
The IUPAC name of 1-(2-methoxyphenyl)-N-(1,2-oxazol-5-ylmethyl)methanamine (CID 103605023) is 1-(2-methoxyphenyl)-N-(1,2-oxazol-5-ylmethyl)methanamine.
What is the SMILES notation for 1-(2-methoxyphenyl)-N-(1,2-oxazol-5-ylmethyl)methanamine?
The canonical SMILES for 1-(2-methoxyphenyl)-N-(1,2-oxazol-5-ylmethyl)methanamine is COc1ccccc1CNCc1ccno1.
What is the InChIKey of 1-(2-methoxyphenyl)-N-(1,2-oxazol-5-ylmethyl)methanamine?
The InChIKey is JOJICYXGQVJMBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O2/c1-15-12-5-3-2-4-10(12)8-13-9-11-6-7-14-16-11/h2-7,13H,8-9H2,1H3.
What are the key properties of 1-(2-methoxyphenyl)-N-(1,2-oxazol-5-ylmethyl)methanamine?
1-(2-methoxyphenyl)-N-(1,2-oxazol-5-ylmethyl)methanamine has a molecular weight of 218.26 g/mol, XLogP of 1.97, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyphenyl)-N-(1,2-oxazol-5-ylmethyl)methanamine is sourced from PubChem (CID 103605023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).