6-[2-(7-methylimidazo[1,2-a]pyridin-2-yl)ethyl]-1,3-benzoxazol-2-amine

C17H16N4O — CID 15684552

IUPAC6-[2-(7-methylimidazo[1,2-a]pyridin-2-yl)ethyl]-1,3-benzoxazol-2-amine
SMILESCc1ccn2cc(CCc3ccc4nc(N)oc4c3)nc2c1
InChIInChI=1S/C17H16N4O/c1-11-6-7-21-10-13(19-16(21)8-11)4-2-12-3-5-14-15(9-12)22-17(18)20-14/h3,5-10H,2,4H2,1H3,(H2,18,20)
InChIKeyPXGAEPWKKBKAEJ-UHFFFAOYSA-N
MW292.34 g/mol
LogP3.15
Rot. Bonds3

About 6-[2-(7-methylimidazo[1,2-a]pyridin-2-yl)ethyl]-1,3-benzoxazol-2-amine

6-[2-(7-methylimidazo[1,2-a]pyridin-2-yl)ethyl]-1,3-benzoxazol-2-amine (PubChem CID 15684552) has the molecular formula C17H16N4O and a molecular weight of 292.34 g/mol. Its IUPAC name is 6-[2-(7-methylimidazo[1,2-a]pyridin-2-yl)ethyl]-1,3-benzoxazol-2-amine.

Molecular Properties

Compound Name6-[2-(7-methylimidazo[1,2-a]pyridin-2-yl)ethyl]-1,3-benzoxazol-2-amine
PubChem CID15684552
Molecular FormulaC17H16N4O
Molecular Weight292.34 g/mol
Exact Mass292.13
IUPAC Name6-[2-(7-methylimidazo[1,2-a]pyridin-2-yl)ethyl]-1,3-benzoxazol-2-amine
SMILESCc1ccn2cc(CCc3ccc4nc(N)oc4c3)nc2c1
InChIInChI=1S/C17H16N4O/c1-11-6-7-21-10-13(19-16(21)8-11)4-2-12-3-5-14-15(9-12)22-17(18)20-14/h3,5-10H,2,4H2,1H3,(H2,18,20)
InChIKeyPXGAEPWKKBKAEJ-UHFFFAOYSA-N
XLogP3.15
TPSA69.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-[2-(7-methylimidazo[1,2-a]pyridin-2-yl)ethyl]-1,3-benzoxazol-2-amine?
The IUPAC name of 6-[2-(7-methylimidazo[1,2-a]pyridin-2-yl)ethyl]-1,3-benzoxazol-2-amine (CID 15684552) is 6-[2-(7-methylimidazo[1,2-a]pyridin-2-yl)ethyl]-1,3-benzoxazol-2-amine.
What is the SMILES notation for 6-[2-(7-methylimidazo[1,2-a]pyridin-2-yl)ethyl]-1,3-benzoxazol-2-amine?
The canonical SMILES for 6-[2-(7-methylimidazo[1,2-a]pyridin-2-yl)ethyl]-1,3-benzoxazol-2-amine is Cc1ccn2cc(CCc3ccc4nc(N)oc4c3)nc2c1.
What is the InChIKey of 6-[2-(7-methylimidazo[1,2-a]pyridin-2-yl)ethyl]-1,3-benzoxazol-2-amine?
The InChIKey is PXGAEPWKKBKAEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N4O/c1-11-6-7-21-10-13(19-16(21)8-11)4-2-12-3-5-14-15(9-12)22-17(18)20-14/h3,5-10H,2,4H2,1H3,(H2,18,20).
What are the key properties of 6-[2-(7-methylimidazo[1,2-a]pyridin-2-yl)ethyl]-1,3-benzoxazol-2-amine?
6-[2-(7-methylimidazo[1,2-a]pyridin-2-yl)ethyl]-1,3-benzoxazol-2-amine has a molecular weight of 292.34 g/mol, XLogP of 3.15, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(7-methylimidazo[1,2-a]pyridin-2-yl)ethyl]-1,3-benzoxazol-2-amine is sourced from PubChem (CID 15684552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).