(3Z)-2-methylidene-7H-pyrido[4,3-h][1,5]oxazonine

C11H10N2O — CID 134590825

IUPAC(3Z)-2-methylidene-7H-pyrido[4,3-h][1,5]oxazonine
SMILESC=C1/C=C\N=C/Cc2ccncc2O1
InChIInChI=1S/C11H10N2O/c1-9-2-5-12-6-3-10-4-7-13-8-11(10)14-9/h2,4-8H,1,3H2/b5-2-,12-6-
InChIKeyDNDUAEVERFYACH-ZTJMISQOSA-N
MW186.21 g/mol
LogP2.11
Rot. Bonds

About (3Z)-2-methylidene-7H-pyrido[4,3-h][1,5]oxazonine

(3Z)-2-methylidene-7H-pyrido[4,3-h][1,5]oxazonine (PubChem CID 134590825) has the molecular formula C11H10N2O and a molecular weight of 186.21 g/mol. Its IUPAC name is (3Z)-2-methylidene-7H-pyrido[4,3-h][1,5]oxazonine.

Molecular Properties

Compound Name(3Z)-2-methylidene-7H-pyrido[4,3-h][1,5]oxazonine
PubChem CID134590825
Molecular FormulaC11H10N2O
Molecular Weight186.21 g/mol
Exact Mass186.08
IUPAC Name(3Z)-2-methylidene-7H-pyrido[4,3-h][1,5]oxazonine
SMILESC=C1/C=C\N=C/Cc2ccncc2O1
InChIInChI=1S/C11H10N2O/c1-9-2-5-12-6-3-10-4-7-13-8-11(10)14-9/h2,4-8H,1,3H2/b5-2-,12-6-
InChIKeyDNDUAEVERFYACH-ZTJMISQOSA-N
XLogP2.11
TPSA34.48 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.21
LogP ≤ 52.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (3Z)-2-methylidene-7H-pyrido[4,3-h][1,5]oxazonine?
The IUPAC name of (3Z)-2-methylidene-7H-pyrido[4,3-h][1,5]oxazonine (CID 134590825) is (3Z)-2-methylidene-7H-pyrido[4,3-h][1,5]oxazonine.
What is the SMILES notation for (3Z)-2-methylidene-7H-pyrido[4,3-h][1,5]oxazonine?
The canonical SMILES for (3Z)-2-methylidene-7H-pyrido[4,3-h][1,5]oxazonine is C=C1/C=C\N=C/Cc2ccncc2O1.
What is the InChIKey of (3Z)-2-methylidene-7H-pyrido[4,3-h][1,5]oxazonine?
The InChIKey is DNDUAEVERFYACH-ZTJMISQOSA-N. The full InChI is InChI=1S/C11H10N2O/c1-9-2-5-12-6-3-10-4-7-13-8-11(10)14-9/h2,4-8H,1,3H2/b5-2-,12-6-.
What are the key properties of (3Z)-2-methylidene-7H-pyrido[4,3-h][1,5]oxazonine?
(3Z)-2-methylidene-7H-pyrido[4,3-h][1,5]oxazonine has a molecular weight of 186.21 g/mol, XLogP of 2.11, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z)-2-methylidene-7H-pyrido[4,3-h][1,5]oxazonine is sourced from PubChem (CID 134590825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).