1-(2-methyl-[1,3]oxazolo[5,4-b]pyridin-6-yl)ethanamine

C9H11N3O — CID 84655967

IUPAC1-(2-methyl-[1,3]oxazolo[5,4-b]pyridin-6-yl)ethanamine
SMILESCc1nc2cc(C(C)N)cnc2o1
InChIInChI=1S/C9H11N3O/c1-5(10)7-3-8-9(11-4-7)13-6(2)12-8/h3-5H,10H2,1-2H3
InChIKeyPYEBSXZYOYLUCS-UHFFFAOYSA-N
MW177.21 g/mol
LogP1.55
Rot. Bonds1

About 1-(2-methyl-[1,3]oxazolo[5,4-b]pyridin-6-yl)ethanamine

1-(2-methyl-[1,3]oxazolo[5,4-b]pyridin-6-yl)ethanamine (PubChem CID 84655967) has the molecular formula C9H11N3O and a molecular weight of 177.21 g/mol. Its IUPAC name is 1-(2-methyl-[1,3]oxazolo[5,4-b]pyridin-6-yl)ethanamine.

Molecular Properties

Compound Name1-(2-methyl-[1,3]oxazolo[5,4-b]pyridin-6-yl)ethanamine
PubChem CID84655967
Molecular FormulaC9H11N3O
Molecular Weight177.21 g/mol
Exact Mass177.09
IUPAC Name1-(2-methyl-[1,3]oxazolo[5,4-b]pyridin-6-yl)ethanamine
SMILESCc1nc2cc(C(C)N)cnc2o1
InChIInChI=1S/C9H11N3O/c1-5(10)7-3-8-9(11-4-7)13-6(2)12-8/h3-5H,10H2,1-2H3
InChIKeyPYEBSXZYOYLUCS-UHFFFAOYSA-N
XLogP1.55
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.21
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-1-(2-methyl-[1,3]oxazolo[5,4-b]pyridin-6-yl)propan-1-ol
CID 84675057
3-amino-2-(2-methyl-[1,3]oxazolo[5,4-b]pyridin-6-yl)propanoic acid
CID 84686471
[5-[(1S)-1-aminoethyl]furo[2,3-b]pyridin-2-yl]methanol
CID 130693886
(1S)-1-furo[2,3-b]pyridin-5-ylethanamine
CID 122237100
(1R)-1-(6-iodo-5-methyl-3-pyridinyl)ethanamine
CID 124503157
1-(2-cyclopropyl-[1,3]oxazolo[5,4-b]pyridin-6-yl)ethanol
CID 84672283
amino-(2-methyl-1,3-benzoxazol-5-yl)methanol
CID 116939676
amino-(2-methyl-1,3-benzoxazol-5-yl)methanethiol
CID 116939524
(1S)-1-(6-chloro-5-fluoro-3-pyridinyl)ethanamine
CID 90451790
2,5-dimethyl-[1,3]oxazolo[5,4-d]pyrimidine;ethane
CID 143085645
1-(6-chloro-[1,3]oxazolo[5,4-b]pyridin-2-yl)propan-2-amine
CID 83885653
hydrazinyl-(2-methyl-1,3-benzoxazol-5-yl)methanamine
CID 116947497

Frequently Asked Questions

What is the IUPAC name of 1-(2-methyl-[1,3]oxazolo[5,4-b]pyridin-6-yl)ethanamine?
The IUPAC name of 1-(2-methyl-[1,3]oxazolo[5,4-b]pyridin-6-yl)ethanamine (CID 84655967) is 1-(2-methyl-[1,3]oxazolo[5,4-b]pyridin-6-yl)ethanamine.
What is the SMILES notation for 1-(2-methyl-[1,3]oxazolo[5,4-b]pyridin-6-yl)ethanamine?
The canonical SMILES for 1-(2-methyl-[1,3]oxazolo[5,4-b]pyridin-6-yl)ethanamine is Cc1nc2cc(C(C)N)cnc2o1.
What is the InChIKey of 1-(2-methyl-[1,3]oxazolo[5,4-b]pyridin-6-yl)ethanamine?
The InChIKey is PYEBSXZYOYLUCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3O/c1-5(10)7-3-8-9(11-4-7)13-6(2)12-8/h3-5H,10H2,1-2H3.
What are the key properties of 1-(2-methyl-[1,3]oxazolo[5,4-b]pyridin-6-yl)ethanamine?
1-(2-methyl-[1,3]oxazolo[5,4-b]pyridin-6-yl)ethanamine has a molecular weight of 177.21 g/mol, XLogP of 1.55, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methyl-[1,3]oxazolo[5,4-b]pyridin-6-yl)ethanamine is sourced from PubChem (CID 84655967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).