(2-amino-7H-purin-6-yl)methanol

C6H7N5O — CID 11593490

IUPAC(2-amino-7H-purin-6-yl)methanol
SMILESNc1nc(CO)c2[nH]cnc2n1
InChIInChI=1S/C6H7N5O/c7-6-10-3(1-12)4-5(11-6)9-2-8-4/h2,12H,1H2,(H3,7,8,9,10,11)
InChIKeyPMRMMZHQJHUHQS-UHFFFAOYSA-N
MW165.16 g/mol
LogP-0.57
Rot. Bonds1

About (2-amino-7H-purin-6-yl)methanol

(2-amino-7H-purin-6-yl)methanol (PubChem CID 11593490) has the molecular formula C6H7N5O and a molecular weight of 165.16 g/mol. Its IUPAC name is (2-amino-7H-purin-6-yl)methanol.

Molecular Properties

Compound Name(2-amino-7H-purin-6-yl)methanol
PubChem CID11593490
Molecular FormulaC6H7N5O
Molecular Weight165.16 g/mol
Exact Mass165.07
IUPAC Name(2-amino-7H-purin-6-yl)methanol
SMILESNc1nc(CO)c2[nH]cnc2n1
InChIInChI=1S/C6H7N5O/c7-6-10-3(1-12)4-5(11-6)9-2-8-4/h2,12H,1H2,(H3,7,8,9,10,11)
InChIKeyPMRMMZHQJHUHQS-UHFFFAOYSA-N
XLogP-0.57
TPSA100.71 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.16
LogP ≤ 5-0.57
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

6-(3-methylbut-2-enyl)-7H-purin-2-amine
CID 67252826
6-[[tert-butyl(methyl)amino]methyl]-7H-purin-2-amine
CID 118699160
6-(pyrrolidin-1-ylmethyl)-7H-purin-2-amine;hydrochloride
CID 173115368
(2,8-diamino-7H-purin-6-yl)methanol
CID 45120876
5-[(2-amino-7H-purin-6-yl)oxy]pentan-1-ol
CID 114216836
azane;6-benzyl-7H-purin-2-amine;nitric acid
CID 174901949
3-[(2-amino-7H-purin-6-yl)sulfanyl]propane-1,2-diol
CID 114788446
6-N-fluoro-7H-purine-2,6-diamine
CID 143836083
2-[(2-amino-7H-purin-6-yl)amino]acetamide
CID 114783660
1-[(2-amino-7H-purin-6-yl)sulfanyl]propan-2-one
CID 3336308
6-(2,2-difluoroethoxy)-7H-purin-2-amine
CID 114787974
6-N-propyl-7H-purine-2,6-diamine
CID 22916641

Frequently Asked Questions

What is the IUPAC name of (2-amino-7H-purin-6-yl)methanol?
The IUPAC name of (2-amino-7H-purin-6-yl)methanol (CID 11593490) is (2-amino-7H-purin-6-yl)methanol.
What is the SMILES notation for (2-amino-7H-purin-6-yl)methanol?
The canonical SMILES for (2-amino-7H-purin-6-yl)methanol is Nc1nc(CO)c2[nH]cnc2n1.
What is the InChIKey of (2-amino-7H-purin-6-yl)methanol?
The InChIKey is PMRMMZHQJHUHQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7N5O/c7-6-10-3(1-12)4-5(11-6)9-2-8-4/h2,12H,1H2,(H3,7,8,9,10,11).
What are the key properties of (2-amino-7H-purin-6-yl)methanol?
(2-amino-7H-purin-6-yl)methanol has a molecular weight of 165.16 g/mol, XLogP of -0.57, 1 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-amino-7H-purin-6-yl)methanol is sourced from PubChem (CID 11593490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).