(2-ethyl-[1,3]oxazolo[5,4-b]pyridin-5-yl)methanamine

C9H11N3O — CID 84655982

IUPAC(2-ethyl-[1,3]oxazolo[5,4-b]pyridin-5-yl)methanamine
SMILESCCc1nc2ccc(CN)nc2o1
InChIInChI=1S/C9H11N3O/c1-2-8-12-7-4-3-6(5-10)11-9(7)13-8/h3-4H,2,5,10H2,1H3
InChIKeyLVPSHRYXWGBEMU-UHFFFAOYSA-N
MW177.21 g/mol
LogP1.24
Rot. Bonds2

About (2-ethyl-[1,3]oxazolo[5,4-b]pyridin-5-yl)methanamine

(2-ethyl-[1,3]oxazolo[5,4-b]pyridin-5-yl)methanamine (PubChem CID 84655982) has the molecular formula C9H11N3O and a molecular weight of 177.21 g/mol. Its IUPAC name is (2-ethyl-[1,3]oxazolo[5,4-b]pyridin-5-yl)methanamine.

Molecular Properties

Compound Name(2-ethyl-[1,3]oxazolo[5,4-b]pyridin-5-yl)methanamine
PubChem CID84655982
Molecular FormulaC9H11N3O
Molecular Weight177.21 g/mol
Exact Mass177.09
IUPAC Name(2-ethyl-[1,3]oxazolo[5,4-b]pyridin-5-yl)methanamine
SMILESCCc1nc2ccc(CN)nc2o1
InChIInChI=1S/C9H11N3O/c1-2-8-12-7-4-3-6(5-10)11-9(7)13-8/h3-4H,2,5,10H2,1H3
InChIKeyLVPSHRYXWGBEMU-UHFFFAOYSA-N
XLogP1.24
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.21
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2-ethyl-[1,3]oxazolo[5,4-b]pyridin-6-yl)methanamine
CID 84655981
(2-ethyl-[1,3]oxazolo[5,4-b]pyridin-7-yl)methanamine
CID 84655980
(2-ethyl-5-methyl-1,3-oxazol-4-yl)methanamine
CID 82502441
(7-ethyl-1,3-benzoxazol-2-yl)methanamine
CID 82229700
2-ethyl-1,3-benzoxazole
CID 23239
2-ethyl-1,3-benzoxazol-7-amine
CID 28752253
7-ethylpyrano[2,3-b]pyridin-2-one
CID 145481174
5-chloro-2-(2-methylpropyl)-[1,3]oxazolo[5,4-b]pyridine
CID 84678071
(2-ethyl-4-methyl-1,3-oxazol-5-yl)methanamine;hydrochloride
CID 119031976
2-ethyl-1,3-benzoxazole-5-thiol
CID 131010364
3-[(2-ethyl-1,3-benzoxazol-5-yl)oxy]propan-1-amine
CID 117098165
2-ethyl-5-fluoro-1,3-benzoxazol-6-amine
CID 70639293

Frequently Asked Questions

What is the IUPAC name of (2-ethyl-[1,3]oxazolo[5,4-b]pyridin-5-yl)methanamine?
The IUPAC name of (2-ethyl-[1,3]oxazolo[5,4-b]pyridin-5-yl)methanamine (CID 84655982) is (2-ethyl-[1,3]oxazolo[5,4-b]pyridin-5-yl)methanamine.
What is the SMILES notation for (2-ethyl-[1,3]oxazolo[5,4-b]pyridin-5-yl)methanamine?
The canonical SMILES for (2-ethyl-[1,3]oxazolo[5,4-b]pyridin-5-yl)methanamine is CCc1nc2ccc(CN)nc2o1.
What is the InChIKey of (2-ethyl-[1,3]oxazolo[5,4-b]pyridin-5-yl)methanamine?
The InChIKey is LVPSHRYXWGBEMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3O/c1-2-8-12-7-4-3-6(5-10)11-9(7)13-8/h3-4H,2,5,10H2,1H3.
What are the key properties of (2-ethyl-[1,3]oxazolo[5,4-b]pyridin-5-yl)methanamine?
(2-ethyl-[1,3]oxazolo[5,4-b]pyridin-5-yl)methanamine has a molecular weight of 177.21 g/mol, XLogP of 1.24, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethyl-[1,3]oxazolo[5,4-b]pyridin-5-yl)methanamine is sourced from PubChem (CID 84655982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).