N-ethyl-3-(3-methylphenyl)-1,2-oxazol-5-amine

C12H14N2O — CID 19082396

IUPACN-ethyl-3-(3-methylphenyl)-1,2-oxazol-5-amine
SMILESCCNc1cc(-c2cccc(C)c2)no1
InChIInChI=1S/C12H14N2O/c1-3-13-12-8-11(14-15-12)10-6-4-5-9(2)7-10/h4-8,13H,3H2,1-2H3
InChIKeyAWUVLAUESBMNKT-UHFFFAOYSA-N
MW202.26 g/mol
LogP3.08
Rot. Bonds3

About N-ethyl-3-(3-methylphenyl)-1,2-oxazol-5-amine

N-ethyl-3-(3-methylphenyl)-1,2-oxazol-5-amine (PubChem CID 19082396) has the molecular formula C12H14N2O and a molecular weight of 202.26 g/mol. Its IUPAC name is N-ethyl-3-(3-methylphenyl)-1,2-oxazol-5-amine.

Molecular Properties

Compound NameN-ethyl-3-(3-methylphenyl)-1,2-oxazol-5-amine
PubChem CID19082396
Molecular FormulaC12H14N2O
Molecular Weight202.26 g/mol
Exact Mass202.11
IUPAC NameN-ethyl-3-(3-methylphenyl)-1,2-oxazol-5-amine
SMILESCCNc1cc(-c2cccc(C)c2)no1
InChIInChI=1S/C12H14N2O/c1-3-13-12-8-11(14-15-12)10-6-4-5-9(2)7-10/h4-8,13H,3H2,1-2H3
InChIKeyAWUVLAUESBMNKT-UHFFFAOYSA-N
XLogP3.08
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

methane;5-methyl-3-(3-methylphenyl)-1,2-oxazole
CID 161177844
5-(1-chloroethyl)-3-(3-methylphenyl)-1,2-oxazole
CID 134528371
2-(ethylamino)-6-(3-methylphenyl)pyridine-3-carbonitrile
CID 62196307
trimethyl-[6-(3-methylphenyl)-3-pyridinyl]silane
CID 166573501
3-(3-methoxyphenyl)-N-methyl-1,2-oxazol-5-amine
CID 134400305
4-(3-methylphenyl)-N-propyl-1,3-thiazol-2-amine
CID 62943868
4-ethyl-5-(3-methylphenyl)-1,2-oxazol-3-amine
CID 66198631
[4-(2,2-dimethylpropyl)-6-(3-methylphenyl)-3-pyridinyl]-trimethylsilane
CID 155611943
5-(3-methylphenyl)-3-pyridin-3-yl-1,2-oxazole
CID 44546226
N-methyl-5-(3-methylphenyl)-1,2,4-oxadiazol-3-amine
CID 56924173
2-(3-methylphenyl)-7-propylquinoline
CID 157170662
5-(2,2-dimethylpropyl)-4-(3-methylphenyl)-1,2-oxazol-3-amine
CID 66199678

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-(3-methylphenyl)-1,2-oxazol-5-amine?
The IUPAC name of N-ethyl-3-(3-methylphenyl)-1,2-oxazol-5-amine (CID 19082396) is N-ethyl-3-(3-methylphenyl)-1,2-oxazol-5-amine.
What is the SMILES notation for N-ethyl-3-(3-methylphenyl)-1,2-oxazol-5-amine?
The canonical SMILES for N-ethyl-3-(3-methylphenyl)-1,2-oxazol-5-amine is CCNc1cc(-c2cccc(C)c2)no1.
What is the InChIKey of N-ethyl-3-(3-methylphenyl)-1,2-oxazol-5-amine?
The InChIKey is AWUVLAUESBMNKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O/c1-3-13-12-8-11(14-15-12)10-6-4-5-9(2)7-10/h4-8,13H,3H2,1-2H3.
What are the key properties of N-ethyl-3-(3-methylphenyl)-1,2-oxazol-5-amine?
N-ethyl-3-(3-methylphenyl)-1,2-oxazol-5-amine has a molecular weight of 202.26 g/mol, XLogP of 3.08, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-(3-methylphenyl)-1,2-oxazol-5-amine is sourced from PubChem (CID 19082396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).