6-(2-amino-6-morpholin-4-ylpyrimidin-4-yl)-1H-indazol-3-amine

C15H17N7O — CID 46214653

IUPAC6-(2-amino-6-morpholin-4-ylpyrimidin-4-yl)-1H-indazol-3-amine
SMILESNc1nc(-c2ccc3c(N)n[nH]c3c2)cc(N2CCOCC2)n1
InChIInChI=1S/C15H17N7O/c16-14-10-2-1-9(7-12(10)20-21-14)11-8-13(19-15(17)18-11)22-3-5-23-6-4-22/h1-2,7-8H,3-6H2,(H3,16,20,21)(H2,17,18,19)
InChIKeyIBSXLFOFZRSWEZ-UHFFFAOYSA-N
MW311.35 g/mol
LogP1.02
Rot. Bonds2

About 6-(2-amino-6-morpholin-4-ylpyrimidin-4-yl)-1H-indazol-3-amine

6-(2-amino-6-morpholin-4-ylpyrimidin-4-yl)-1H-indazol-3-amine (PubChem CID 46214653) has the molecular formula C15H17N7O and a molecular weight of 311.35 g/mol. Its IUPAC name is 6-(2-amino-6-morpholin-4-ylpyrimidin-4-yl)-1H-indazol-3-amine.

Molecular Properties

Compound Name6-(2-amino-6-morpholin-4-ylpyrimidin-4-yl)-1H-indazol-3-amine
PubChem CID46214653
Molecular FormulaC15H17N7O
Molecular Weight311.35 g/mol
Exact Mass311.15
IUPAC Name6-(2-amino-6-morpholin-4-ylpyrimidin-4-yl)-1H-indazol-3-amine
SMILESNc1nc(-c2ccc3c(N)n[nH]c3c2)cc(N2CCOCC2)n1
InChIInChI=1S/C15H17N7O/c16-14-10-2-1-9(7-12(10)20-21-14)11-8-13(19-15(17)18-11)22-3-5-23-6-4-22/h1-2,7-8H,3-6H2,(H3,16,20,21)(H2,17,18,19)
InChIKeyIBSXLFOFZRSWEZ-UHFFFAOYSA-N
XLogP1.02
TPSA118.97 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.35
LogP ≤ 51.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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Related Compounds

Gsk-2334470
CID 46215815
6-(3-Amino-2h-Indazol-6-Yl)-N~4~-Ethylpyrimidine-2,4-Diamine
CID 46214652
6-{2-Amino-6-[(3r)-3-Methylmorpholin-4-Yl]pyrimidin-4-Yl}-2h-Indazol-3-Amine
CID 46215988
(3s,6r)-1-[2-Amino-6-(3-Amino-2h-Indazol-6-Yl)pyrimidin-4-Yl]-6-Methyl-N-Phenylpiperidine-3-Carboxamide
CID 50909915
Tert-Butyl {(3r,6s)-1-[2-Amino-6-(3-Amino-2h-Indazol-6-Yl)pyrimidin-4-Yl]-6-Methylpiperidin-3-Yl}carbamate
CID 50909916
Tert-Butyl {(3r,5r)-1-[2-Amino-6-(3-Amino-2h-Indazol-6-Yl)pyrimidin-4-Yl]-5-Methylpiperidin-3-Yl}carbamate
CID 50909917
N-{(3R,5R)-1-[2-amino-6-(3-amino-1H-indazol-6-yl)-4-pyrimidinyl]-5-methyl-3-piperidinyl}-N,3,3-trimethylbutanamide
CID 51354613
1,1-Dimethylethyl{(3R,5R)-1-[2-Amino-6-(3-amino-1H-indazol-6-yl)-4-pyrimidinyl]-5-methyl-3-piperidinyl}methylcarbamate
CID 54581311
c-KIT/PDGFRalpha Inhibitor C31
CID 132585195
3-(4-fluorophenyl)-2,5-dimethyl-N-[3-(morpholin-4-yl)propyl]pyrazolo[1,5-a]pyrimidin-7-amine
CID 647327
Pyrazolo pyrimidine, 5q
CID 44520821
6-(2-Aminopyrimidin-4-Yl)-1h-Indazol-3-Amine
CID 46215814

Frequently Asked Questions

What is the IUPAC name of 6-(2-amino-6-morpholin-4-ylpyrimidin-4-yl)-1H-indazol-3-amine?
The IUPAC name of 6-(2-amino-6-morpholin-4-ylpyrimidin-4-yl)-1H-indazol-3-amine (CID 46214653) is 6-(2-amino-6-morpholin-4-ylpyrimidin-4-yl)-1H-indazol-3-amine.
What is the SMILES notation for 6-(2-amino-6-morpholin-4-ylpyrimidin-4-yl)-1H-indazol-3-amine?
The canonical SMILES for 6-(2-amino-6-morpholin-4-ylpyrimidin-4-yl)-1H-indazol-3-amine is Nc1nc(-c2ccc3c(N)n[nH]c3c2)cc(N2CCOCC2)n1.
What is the InChIKey of 6-(2-amino-6-morpholin-4-ylpyrimidin-4-yl)-1H-indazol-3-amine?
The InChIKey is IBSXLFOFZRSWEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N7O/c16-14-10-2-1-9(7-12(10)20-21-14)11-8-13(19-15(17)18-11)22-3-5-23-6-4-22/h1-2,7-8H,3-6H2,(H3,16,20,21)(H2,17,18,19).
What are the key properties of 6-(2-amino-6-morpholin-4-ylpyrimidin-4-yl)-1H-indazol-3-amine?
6-(2-amino-6-morpholin-4-ylpyrimidin-4-yl)-1H-indazol-3-amine has a molecular weight of 311.35 g/mol, XLogP of 1.02, 2 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-amino-6-morpholin-4-ylpyrimidin-4-yl)-1H-indazol-3-amine is sourced from PubChem (CID 46214653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).