3-(1,5-dimethyl-2,3-dihydroinden-1-yl)-1,2-oxazol-4-amine

C14H16N2O — CID 139770443

IUPAC3-(1,5-dimethyl-2,3-dihydroinden-1-yl)-1,2-oxazol-4-amine
SMILESCc1ccc2c(c1)CCC2(C)c1nocc1N
InChIInChI=1S/C14H16N2O/c1-9-3-4-11-10(7-9)5-6-14(11,2)13-12(15)8-17-16-13/h3-4,7-8H,5-6,15H2,1-2H3
InChIKeyXHFDSVJRTLJGGC-UHFFFAOYSA-N
MW228.29 g/mol
LogP2.82
Rot. Bonds1

About 3-(1,5-dimethyl-2,3-dihydroinden-1-yl)-1,2-oxazol-4-amine

3-(1,5-dimethyl-2,3-dihydroinden-1-yl)-1,2-oxazol-4-amine (PubChem CID 139770443) has the molecular formula C14H16N2O and a molecular weight of 228.29 g/mol. Its IUPAC name is 3-(1,5-dimethyl-2,3-dihydroinden-1-yl)-1,2-oxazol-4-amine.

Molecular Properties

Compound Name3-(1,5-dimethyl-2,3-dihydroinden-1-yl)-1,2-oxazol-4-amine
PubChem CID139770443
Molecular FormulaC14H16N2O
Molecular Weight228.29 g/mol
Exact Mass228.13
IUPAC Name3-(1,5-dimethyl-2,3-dihydroinden-1-yl)-1,2-oxazol-4-amine
SMILESCc1ccc2c(c1)CCC2(C)c1nocc1N
InChIInChI=1S/C14H16N2O/c1-9-3-4-11-10(7-9)5-6-14(11,2)13-12(15)8-17-16-13/h3-4,7-8H,5-6,15H2,1-2H3
InChIKeyXHFDSVJRTLJGGC-UHFFFAOYSA-N
XLogP2.82
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(1,7-dimethyl-3,4-dihydro-2H-naphthalen-1-yl)-N-methyl-1,2-oxazol-4-amine
CID 139770543
7-(2,4-dimethylphenyl)-2,7-dimethyl-5,6-dihydrocyclopenta[d]pyrimidine
CID 141107797
3-(1,6-dimethyl-1,2,3,4-tetrahydronaphthalen-2-yl)-1,2-oxazol-4-amine
CID 139770536
1,6-dimethyl-3,4-dihydro-2H-naphthalene-1-carboxylic acid
CID 84721907
6-methylspiro[3,4-dihydronaphthalene-1,1'-cyclobutane]-2-one
CID 115010954
1-(2-amino-4-methylphenyl)cyclopropane-1-carbaldehyde
CID 143152801
3-isocyanato-3,6-dimethyl-1,2-dihydroindene
CID 115017302
2-ethyl-1,1,6-trimethyl-3,4-dihydroisoquinoline
CID 58289854
3-(4,7-dimethyl-1,2,3,4-tetrahydronaphthalen-1-yl)-1,2-oxazol-4-amine
CID 139770472
4-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-2,1,3-benzoxadiazol-7-amine
CID 43518422
(1-amino-6-methyl-3,4-dihydro-2H-naphthalen-1-yl)methanol
CID 83907370
1,2,2,5-tetramethyl-3H-inden-1-amine
CID 24782448

Frequently Asked Questions

What is the IUPAC name of 3-(1,5-dimethyl-2,3-dihydroinden-1-yl)-1,2-oxazol-4-amine?
The IUPAC name of 3-(1,5-dimethyl-2,3-dihydroinden-1-yl)-1,2-oxazol-4-amine (CID 139770443) is 3-(1,5-dimethyl-2,3-dihydroinden-1-yl)-1,2-oxazol-4-amine.
What is the SMILES notation for 3-(1,5-dimethyl-2,3-dihydroinden-1-yl)-1,2-oxazol-4-amine?
The canonical SMILES for 3-(1,5-dimethyl-2,3-dihydroinden-1-yl)-1,2-oxazol-4-amine is Cc1ccc2c(c1)CCC2(C)c1nocc1N.
What is the InChIKey of 3-(1,5-dimethyl-2,3-dihydroinden-1-yl)-1,2-oxazol-4-amine?
The InChIKey is XHFDSVJRTLJGGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O/c1-9-3-4-11-10(7-9)5-6-14(11,2)13-12(15)8-17-16-13/h3-4,7-8H,5-6,15H2,1-2H3.
What are the key properties of 3-(1,5-dimethyl-2,3-dihydroinden-1-yl)-1,2-oxazol-4-amine?
3-(1,5-dimethyl-2,3-dihydroinden-1-yl)-1,2-oxazol-4-amine has a molecular weight of 228.29 g/mol, XLogP of 2.82, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1,5-dimethyl-2,3-dihydroinden-1-yl)-1,2-oxazol-4-amine is sourced from PubChem (CID 139770443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).