4-morpholin-4-yl-1H-indazol-3-amine

C11H14N4O — CID 57494570

IUPAC4-morpholin-4-yl-1H-indazol-3-amine
SMILESNc1n[nH]c2cccc(N3CCOCC3)c12
InChIInChI=1S/C11H14N4O/c12-11-10-8(13-14-11)2-1-3-9(10)15-4-6-16-7-5-15/h1-3H,4-7H2,(H3,12,13,14)
InChIKeyMTUHEFSYPUASJZ-UHFFFAOYSA-N
MW218.26 g/mol
LogP0.98
Rot. Bonds1

About 4-morpholin-4-yl-1H-indazol-3-amine

4-morpholin-4-yl-1H-indazol-3-amine (PubChem CID 57494570) has the molecular formula C11H14N4O and a molecular weight of 218.26 g/mol. Its IUPAC name is 4-morpholin-4-yl-1H-indazol-3-amine.

Molecular Properties

Compound Name4-morpholin-4-yl-1H-indazol-3-amine
PubChem CID57494570
Molecular FormulaC11H14N4O
Molecular Weight218.26 g/mol
Exact Mass218.12
IUPAC Name4-morpholin-4-yl-1H-indazol-3-amine
SMILESNc1n[nH]c2cccc(N3CCOCC3)c12
InChIInChI=1S/C11H14N4O/c12-11-10-8(13-14-11)2-1-3-9(10)15-4-6-16-7-5-15/h1-3H,4-7H2,(H3,12,13,14)
InChIKeyMTUHEFSYPUASJZ-UHFFFAOYSA-N
XLogP0.98
TPSA67.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-morpholin-4-yl-1H-indazol-3-amine?
The IUPAC name of 4-morpholin-4-yl-1H-indazol-3-amine (CID 57494570) is 4-morpholin-4-yl-1H-indazol-3-amine.
What is the SMILES notation for 4-morpholin-4-yl-1H-indazol-3-amine?
The canonical SMILES for 4-morpholin-4-yl-1H-indazol-3-amine is Nc1n[nH]c2cccc(N3CCOCC3)c12.
What is the InChIKey of 4-morpholin-4-yl-1H-indazol-3-amine?
The InChIKey is MTUHEFSYPUASJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O/c12-11-10-8(13-14-11)2-1-3-9(10)15-4-6-16-7-5-15/h1-3H,4-7H2,(H3,12,13,14).
What are the key properties of 4-morpholin-4-yl-1H-indazol-3-amine?
4-morpholin-4-yl-1H-indazol-3-amine has a molecular weight of 218.26 g/mol, XLogP of 0.98, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-morpholin-4-yl-1H-indazol-3-amine is sourced from PubChem (CID 57494570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).