methanol;7H-purin-6-amine

C6H9N5O — CID 67194832

IUPACmethanol;7H-purin-6-amine
SMILESCO.Nc1ncnc2nc[nH]c12
InChIInChI=1S/C5H5N5.CH4O/c6-4-3-5(9-1-7-3)10-2-8-4;1-2/h1-2H,(H3,6,7,8,9,10);2H,1H3
InChIKeyGHJGLRJYQPJYCO-UHFFFAOYSA-N
MW167.17 g/mol
LogP-0.46
Rot. Bonds

About methanol;7H-purin-6-amine

methanol;7H-purin-6-amine (PubChem CID 67194832) has the molecular formula C6H9N5O and a molecular weight of 167.17 g/mol. Its IUPAC name is methanol;7H-purin-6-amine.

Molecular Properties

Compound Namemethanol;7H-purin-6-amine
PubChem CID67194832
Molecular FormulaC6H9N5O
Molecular Weight167.17 g/mol
Exact Mass167.08
IUPAC Namemethanol;7H-purin-6-amine
SMILESCO.Nc1ncnc2nc[nH]c12
InChIInChI=1S/C5H5N5.CH4O/c6-4-3-5(9-1-7-3)10-2-8-4;1-2/h1-2H,(H3,6,7,8,9,10);2H,1H3
InChIKeyGHJGLRJYQPJYCO-UHFFFAOYSA-N
XLogP-0.46
TPSA100.71 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.17
LogP ≤ 5-0.46
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze methanol;7H-purin-6-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

7H-purin-6-amine;hydrochloride
CID 169432832
CID 67796265
CID 67796265
dicopper;dioxidanium;tetrakis(7H-purin-6-amine)
CID 5231973
bis(7H-purin-6-amine);sulfate
CID 23616791
4-(4-aminophenyl)aniline;7H-purin-6-amine
CID 160907606
sodium;2-hydroxypropanoate;7H-purin-6-amine
CID 175024161
5-aminooxan-3-ol;methanol;7H-purin-6-amine
CID 176998987
octadecanoic acid;7H-purin-6-amine
CID 141436047
2-(methylamino)-3-sulfanylpropanoic acid;7H-purin-6-amine
CID 174836451
benzamide;7H-purin-6-amine
CID 66705736
ethane;2-methylbutan-1-amine;7H-purin-6-amine
CID 144555996
methanol;bis(7H-purin-6-amine);bis(pyridine-3-carboxamide)
CID 67811269

Frequently Asked Questions

What is the IUPAC name of methanol;7H-purin-6-amine?
The IUPAC name of methanol;7H-purin-6-amine (CID 67194832) is methanol;7H-purin-6-amine.
What is the SMILES notation for methanol;7H-purin-6-amine?
The canonical SMILES for methanol;7H-purin-6-amine is CO.Nc1ncnc2nc[nH]c12.
What is the InChIKey of methanol;7H-purin-6-amine?
The InChIKey is GHJGLRJYQPJYCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5N5.CH4O/c6-4-3-5(9-1-7-3)10-2-8-4;1-2/h1-2H,(H3,6,7,8,9,10);2H,1H3.
What are the key properties of methanol;7H-purin-6-amine?
methanol;7H-purin-6-amine has a molecular weight of 167.17 g/mol, XLogP of -0.46, 0 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methanol;7H-purin-6-amine is sourced from PubChem (CID 67194832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).