2-(2,3-dihydro-1H-inden-1-yl)-3-pyridin-3-yl-3H-1,2-oxazol-5-amine

C17H17N3O — CID 141063552

IUPAC2-(2,3-dihydro-1H-inden-1-yl)-3-pyridin-3-yl-3H-1,2-oxazol-5-amine
SMILESNC1=CC(c2cccnc2)N(C2CCc3ccccc32)O1
InChIInChI=1S/C17H17N3O/c18-17-10-16(13-5-3-9-19-11-13)20(21-17)15-8-7-12-4-1-2-6-14(12)15/h1-6,9-11,15-16H,7-8,18H2
InChIKeyCHGZHOOOLAQEGM-UHFFFAOYSA-N
MW279.34 g/mol
LogP2.86
Rot. Bonds2

About 2-(2,3-dihydro-1H-inden-1-yl)-3-pyridin-3-yl-3H-1,2-oxazol-5-amine

2-(2,3-dihydro-1H-inden-1-yl)-3-pyridin-3-yl-3H-1,2-oxazol-5-amine (PubChem CID 141063552) has the molecular formula C17H17N3O and a molecular weight of 279.34 g/mol. Its IUPAC name is 2-(2,3-dihydro-1H-inden-1-yl)-3-pyridin-3-yl-3H-1,2-oxazol-5-amine.

Molecular Properties

Compound Name2-(2,3-dihydro-1H-inden-1-yl)-3-pyridin-3-yl-3H-1,2-oxazol-5-amine
PubChem CID141063552
Molecular FormulaC17H17N3O
Molecular Weight279.34 g/mol
Exact Mass279.14
IUPAC Name2-(2,3-dihydro-1H-inden-1-yl)-3-pyridin-3-yl-3H-1,2-oxazol-5-amine
SMILESNC1=CC(c2cccnc2)N(C2CCc3ccccc32)O1
InChIInChI=1S/C17H17N3O/c18-17-10-16(13-5-3-9-19-11-13)20(21-17)15-8-7-12-4-1-2-6-14(12)15/h1-6,9-11,15-16H,7-8,18H2
InChIKeyCHGZHOOOLAQEGM-UHFFFAOYSA-N
XLogP2.86
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(2,3-dihydro-1H-inden-1-yl)-3-pyridin-3-yl-3H-1,2-oxazol-5-amine with MolForge

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Related Compounds

3-(6-methoxy-3-pyridinyl)-2-(1,2,3,4-tetrahydronaphthalen-1-yl)-3H-1,2-oxazol-5-amine
CID 141063449
2-(2,3-dihydro-1H-inden-1-yl)pyrazol-3-amine
CID 16793666
(2S)-1-pyridin-3-yl-1,2,3,4-tetrahydronaphthalen-2-amine
CID 176872171
2-(6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-yl)pyrazol-3-amine
CID 16788368
pyridin-3-yl-(1-pyridin-3-yl-3,4-dihydro-1H-isoquinolin-2-yl)methanone
CID 110400545
1-(2,3-dihydro-1H-inden-1-yl)-2,5-dimethyl-4-pyridin-3-ylpyrrole-3-carboxamide
CID 3679809
(1R)-1-pyridin-3-yl-2,3-dihydro-1H-isoindole
CID 177219714
1-(pyridin-3-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-amine;dihydrochloride
CID 22037055
2-pyridin-3-ylpiperidin-1-amine
CID 5026347
(1S)-2,3-dihydro-1H-inden-1-amine
CID 7000084
7-(2,3-dihydro-1H-inden-1-yl)-5,5-dimethyl-2-(pyridin-3-ylamino)pyrrolo[2,3-d]pyrimidin-6-one
CID 44548056
(2-fluorophenyl)-(1-pyridin-3-yl-3,4-dihydro-1H-isoquinolin-2-yl)methanone
CID 110400518

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1H-inden-1-yl)-3-pyridin-3-yl-3H-1,2-oxazol-5-amine?
The IUPAC name of 2-(2,3-dihydro-1H-inden-1-yl)-3-pyridin-3-yl-3H-1,2-oxazol-5-amine (CID 141063552) is 2-(2,3-dihydro-1H-inden-1-yl)-3-pyridin-3-yl-3H-1,2-oxazol-5-amine.
What is the SMILES notation for 2-(2,3-dihydro-1H-inden-1-yl)-3-pyridin-3-yl-3H-1,2-oxazol-5-amine?
The canonical SMILES for 2-(2,3-dihydro-1H-inden-1-yl)-3-pyridin-3-yl-3H-1,2-oxazol-5-amine is NC1=CC(c2cccnc2)N(C2CCc3ccccc32)O1.
What is the InChIKey of 2-(2,3-dihydro-1H-inden-1-yl)-3-pyridin-3-yl-3H-1,2-oxazol-5-amine?
The InChIKey is CHGZHOOOLAQEGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O/c18-17-10-16(13-5-3-9-19-11-13)20(21-17)15-8-7-12-4-1-2-6-14(12)15/h1-6,9-11,15-16H,7-8,18H2.
What are the key properties of 2-(2,3-dihydro-1H-inden-1-yl)-3-pyridin-3-yl-3H-1,2-oxazol-5-amine?
2-(2,3-dihydro-1H-inden-1-yl)-3-pyridin-3-yl-3H-1,2-oxazol-5-amine has a molecular weight of 279.34 g/mol, XLogP of 2.86, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1H-inden-1-yl)-3-pyridin-3-yl-3H-1,2-oxazol-5-amine is sourced from PubChem (CID 141063552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).