2-(3-methyl-2H-indazol-6-yl)morpholine

C12H15N3O — CID 123183606

IUPAC2-(3-methyl-2H-indazol-6-yl)morpholine
SMILESCc1[nH]nc2cc(C3CNCCO3)ccc12
InChIInChI=1S/C12H15N3O/c1-8-10-3-2-9(6-11(10)15-14-8)12-7-13-4-5-16-12/h2-3,6,12-13H,4-5,7H2,1H3,(H,14,15)
InChIKeyBCYIFBWEFBFGOT-UHFFFAOYSA-N
MW217.27 g/mol
LogP1.53
Rot. Bonds1

About 2-(3-methyl-2H-indazol-6-yl)morpholine

2-(3-methyl-2H-indazol-6-yl)morpholine (PubChem CID 123183606) has the molecular formula C12H15N3O and a molecular weight of 217.27 g/mol. Its IUPAC name is 2-(3-methyl-2H-indazol-6-yl)morpholine.

Molecular Properties

Compound Name2-(3-methyl-2H-indazol-6-yl)morpholine
PubChem CID123183606
Molecular FormulaC12H15N3O
Molecular Weight217.27 g/mol
Exact Mass217.12
IUPAC Name2-(3-methyl-2H-indazol-6-yl)morpholine
SMILESCc1[nH]nc2cc(C3CNCCO3)ccc12
InChIInChI=1S/C12H15N3O/c1-8-10-3-2-9(6-11(10)15-14-8)12-7-13-4-5-16-12/h2-3,6,12-13H,4-5,7H2,1H3,(H,14,15)
InChIKeyBCYIFBWEFBFGOT-UHFFFAOYSA-N
XLogP1.53
TPSA49.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.27
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3-methyl-2H-indazol-6-yl)morpholine?
The IUPAC name of 2-(3-methyl-2H-indazol-6-yl)morpholine (CID 123183606) is 2-(3-methyl-2H-indazol-6-yl)morpholine.
What is the SMILES notation for 2-(3-methyl-2H-indazol-6-yl)morpholine?
The canonical SMILES for 2-(3-methyl-2H-indazol-6-yl)morpholine is Cc1[nH]nc2cc(C3CNCCO3)ccc12.
What is the InChIKey of 2-(3-methyl-2H-indazol-6-yl)morpholine?
The InChIKey is BCYIFBWEFBFGOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O/c1-8-10-3-2-9(6-11(10)15-14-8)12-7-13-4-5-16-12/h2-3,6,12-13H,4-5,7H2,1H3,(H,14,15).
What are the key properties of 2-(3-methyl-2H-indazol-6-yl)morpholine?
2-(3-methyl-2H-indazol-6-yl)morpholine has a molecular weight of 217.27 g/mol, XLogP of 1.53, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methyl-2H-indazol-6-yl)morpholine is sourced from PubChem (CID 123183606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).