2-[(2-amino-7H-purin-6-yl)amino]acetamide

C7H9N7O — CID 114783660

IUPAC2-[(2-amino-7H-purin-6-yl)amino]acetamide
SMILESNC(=O)CNc1nc(N)nc2nc[nH]c12
InChIInChI=1S/C7H9N7O/c8-3(15)1-10-5-4-6(12-2-11-4)14-7(9)13-5/h2H,1H2,(H2,8,15)(H4,9,10,11,12,13,14)
InChIKeyDXVYCHNZCJPIRF-UHFFFAOYSA-N
MW207.20 g/mol
LogP-1.17
Rot. Bonds3

About 2-[(2-amino-7H-purin-6-yl)amino]acetamide

2-[(2-amino-7H-purin-6-yl)amino]acetamide (PubChem CID 114783660) has the molecular formula C7H9N7O and a molecular weight of 207.20 g/mol. Its IUPAC name is 2-[(2-amino-7H-purin-6-yl)amino]acetamide.

Molecular Properties

Compound Name2-[(2-amino-7H-purin-6-yl)amino]acetamide
PubChem CID114783660
Molecular FormulaC7H9N7O
Molecular Weight207.20 g/mol
Exact Mass207.09
IUPAC Name2-[(2-amino-7H-purin-6-yl)amino]acetamide
SMILESNC(=O)CNc1nc(N)nc2nc[nH]c12
InChIInChI=1S/C7H9N7O/c8-3(15)1-10-5-4-6(12-2-11-4)14-7(9)13-5/h2H,1H2,(H2,8,15)(H4,9,10,11,12,13,14)
InChIKeyDXVYCHNZCJPIRF-UHFFFAOYSA-N
XLogP-1.17
TPSA135.60 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.20
LogP ≤ 5-1.17
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

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Related Compounds

3-[(2-amino-7H-purin-6-yl)amino]propanamide
CID 114783932
2-[(2-amino-7H-purin-6-yl)amino]-N-ethyl-N-methylacetamide
CID 104925667
3-[(2-amino-7H-purin-6-yl)amino]-3-methylbutanamide
CID 114143219
6-N-propyl-7H-purine-2,6-diamine
CID 22916641
5-[(2-amino-7H-purin-6-yl)amino]pentan-2-ol
CID 107269141
3-[(2-amino-7H-purin-6-yl)amino]-N-tert-butylpropanamide
CID 104623604
5-[(2-amino-7H-purin-6-yl)amino]-N-hydroxypentanamide
CID 127025055
4-[[(2-amino-7H-purin-6-yl)amino]methyl]phenol
CID 86271711
6-N-fluoro-7H-purine-2,6-diamine
CID 143836083
6-N-(2,3-dimethylbutyl)-7H-purine-2,6-diamine
CID 104623745
6-N-tert-butyl-7H-purine-2,6-diamine
CID 114783406
4-[[(2-amino-7H-purin-6-yl)amino]methyl]piperidine-1-carboxylic acid
CID 91465620

Frequently Asked Questions

What is the IUPAC name of 2-[(2-amino-7H-purin-6-yl)amino]acetamide?
The IUPAC name of 2-[(2-amino-7H-purin-6-yl)amino]acetamide (CID 114783660) is 2-[(2-amino-7H-purin-6-yl)amino]acetamide.
What is the SMILES notation for 2-[(2-amino-7H-purin-6-yl)amino]acetamide?
The canonical SMILES for 2-[(2-amino-7H-purin-6-yl)amino]acetamide is NC(=O)CNc1nc(N)nc2nc[nH]c12.
What is the InChIKey of 2-[(2-amino-7H-purin-6-yl)amino]acetamide?
The InChIKey is DXVYCHNZCJPIRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N7O/c8-3(15)1-10-5-4-6(12-2-11-4)14-7(9)13-5/h2H,1H2,(H2,8,15)(H4,9,10,11,12,13,14).
What are the key properties of 2-[(2-amino-7H-purin-6-yl)amino]acetamide?
2-[(2-amino-7H-purin-6-yl)amino]acetamide has a molecular weight of 207.20 g/mol, XLogP of -1.17, 3 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-amino-7H-purin-6-yl)amino]acetamide is sourced from PubChem (CID 114783660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).