6-N-ethyl-6-N-[(6-methyl-2-pyridinyl)methyl]-7H-purine-2,6-diamine

C14H17N7 — CID 114785682

IUPAC6-N-ethyl-6-N-[(6-methyl-2-pyridinyl)methyl]-7H-purine-2,6-diamine
SMILESCCN(Cc1cccc(C)n1)c1nc(N)nc2nc[nH]c12
InChIInChI=1S/C14H17N7/c1-3-21(7-10-6-4-5-9(2)18-10)13-11-12(17-8-16-11)19-14(15)20-13/h4-6,8H,3,7H2,1-2H3,(H3,15,16,17,19,20)
InChIKeyGBMYEFNTZCYQGN-UHFFFAOYSA-N
MW283.34 g/mol
LogP1.67
Rot. Bonds4

About 6-N-ethyl-6-N-[(6-methyl-2-pyridinyl)methyl]-7H-purine-2,6-diamine

6-N-ethyl-6-N-[(6-methyl-2-pyridinyl)methyl]-7H-purine-2,6-diamine (PubChem CID 114785682) has the molecular formula C14H17N7 and a molecular weight of 283.34 g/mol. Its IUPAC name is 6-N-ethyl-6-N-[(6-methyl-2-pyridinyl)methyl]-7H-purine-2,6-diamine.

Molecular Properties

Compound Name6-N-ethyl-6-N-[(6-methyl-2-pyridinyl)methyl]-7H-purine-2,6-diamine
PubChem CID114785682
Molecular FormulaC14H17N7
Molecular Weight283.34 g/mol
Exact Mass283.15
IUPAC Name6-N-ethyl-6-N-[(6-methyl-2-pyridinyl)methyl]-7H-purine-2,6-diamine
SMILESCCN(Cc1cccc(C)n1)c1nc(N)nc2nc[nH]c12
InChIInChI=1S/C14H17N7/c1-3-21(7-10-6-4-5-9(2)18-10)13-11-12(17-8-16-11)19-14(15)20-13/h4-6,8H,3,7H2,1-2H3,(H3,15,16,17,19,20)
InChIKeyGBMYEFNTZCYQGN-UHFFFAOYSA-N
XLogP1.67
TPSA96.61 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.34
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 6-N-ethyl-6-N-[(6-methyl-2-pyridinyl)methyl]-7H-purine-2,6-diamine 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

1-[(2-amino-7H-purin-6-yl)-ethylamino]-2-methylpropan-2-ol
CID 104623697
2-N-ethyl-2-N-[(6-methyl-2-pyridinyl)methyl]pyrazine-2,5-diamine
CID 80652405
6-N,6-N-bis(furan-2-ylmethyl)-7H-purine-2,6-diamine
CID 75505978
N-benzyl-2-chloro-N-ethyl-7H-purin-6-amine
CID 104787062
2-[(2-amino-7H-purin-6-yl)-benzylamino]ethanol
CID 114784943
6-N-benzyl-6-N-propan-2-yl-7H-purine-2,6-diamine
CID 114783307
2-[(2-amino-7H-purin-6-yl)-methylamino]-N,N-diethylacetamide
CID 115669354
4-N-ethyl-4-N-[(6-methyl-2-pyridinyl)methyl]-2-methylsulfanylpyrimidine-4,6-diamine
CID 80851849
6-N-(2-ethoxyethyl)-6-N-methyl-7H-purine-2,6-diamine
CID 104623920
6-N-methyl-6-N-(2-phenylethyl)-7H-purine-2,6-diamine
CID 44776717
6-N-[(3-methoxyphenyl)methyl]-6-N-methyl-7H-purine-2,6-diamine
CID 115669342
3,5,6-trichloro-N-ethyl-N-[(6-methyl-2-pyridinyl)methyl]pyridin-2-amine
CID 102751537

Frequently Asked Questions

What is the IUPAC name of 6-N-ethyl-6-N-[(6-methyl-2-pyridinyl)methyl]-7H-purine-2,6-diamine?
The IUPAC name of 6-N-ethyl-6-N-[(6-methyl-2-pyridinyl)methyl]-7H-purine-2,6-diamine (CID 114785682) is 6-N-ethyl-6-N-[(6-methyl-2-pyridinyl)methyl]-7H-purine-2,6-diamine.
What is the SMILES notation for 6-N-ethyl-6-N-[(6-methyl-2-pyridinyl)methyl]-7H-purine-2,6-diamine?
The canonical SMILES for 6-N-ethyl-6-N-[(6-methyl-2-pyridinyl)methyl]-7H-purine-2,6-diamine is CCN(Cc1cccc(C)n1)c1nc(N)nc2nc[nH]c12.
What is the InChIKey of 6-N-ethyl-6-N-[(6-methyl-2-pyridinyl)methyl]-7H-purine-2,6-diamine?
The InChIKey is GBMYEFNTZCYQGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N7/c1-3-21(7-10-6-4-5-9(2)18-10)13-11-12(17-8-16-11)19-14(15)20-13/h4-6,8H,3,7H2,1-2H3,(H3,15,16,17,19,20).
What are the key properties of 6-N-ethyl-6-N-[(6-methyl-2-pyridinyl)methyl]-7H-purine-2,6-diamine?
6-N-ethyl-6-N-[(6-methyl-2-pyridinyl)methyl]-7H-purine-2,6-diamine has a molecular weight of 283.34 g/mol, XLogP of 1.67, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-ethyl-6-N-[(6-methyl-2-pyridinyl)methyl]-7H-purine-2,6-diamine is sourced from PubChem (CID 114785682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).