6-N,6-N-diethylquinazoline-2,4,6-triamine

C12H17N5 — CID 44531790

IUPAC6-N,6-N-diethylquinazoline-2,4,6-triamine
SMILESCCN(CC)c1ccc2nc(N)nc(N)c2c1
InChIInChI=1S/C12H17N5/c1-3-17(4-2)8-5-6-10-9(7-8)11(13)16-12(14)15-10/h5-7H,3-4H2,1-2H3,(H4,13,14,15,16)
InChIKeyOFRJUJRMWYMLFC-UHFFFAOYSA-N
MW231.30 g/mol
LogP1.64
Rot. Bonds3

About 6-N,6-N-diethylquinazoline-2,4,6-triamine

6-N,6-N-diethylquinazoline-2,4,6-triamine (PubChem CID 44531790) has the molecular formula C12H17N5 and a molecular weight of 231.30 g/mol. Its IUPAC name is 6-N,6-N-diethylquinazoline-2,4,6-triamine.

Molecular Properties

Compound Name6-N,6-N-diethylquinazoline-2,4,6-triamine
PubChem CID44531790
Molecular FormulaC12H17N5
Molecular Weight231.30 g/mol
Exact Mass231.15
IUPAC Name6-N,6-N-diethylquinazoline-2,4,6-triamine
SMILESCCN(CC)c1ccc2nc(N)nc(N)c2c1
InChIInChI=1S/C12H17N5/c1-3-17(4-2)8-5-6-10-9(7-8)11(13)16-12(14)15-10/h5-7H,3-4H2,1-2H3,(H4,13,14,15,16)
InChIKeyOFRJUJRMWYMLFC-UHFFFAOYSA-N
XLogP1.64
TPSA81.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-N,6-N,3-triethyl-2-methylquinoline-4,6-diamine
CID 63180558
6-N-[[4-(benzenesulfonyl)phenyl]methyl]-6-N-ethylquinazoline-2,4,6-triamine
CID 10252312
6-N,6-N,2-triethylquinoline-4,6-diamine
CID 63180601
N,N,2-triethyl-4-hydrazinylquinolin-6-amine
CID 63180817
2,4-diaminoquinazoline-6-thiol
CID 91618965
6-(nitrosomethyl)quinazoline-2,4-diamine
CID 172623336
N-(2,4-diaminoquinazolin-6-yl)-N-(thiophen-2-ylmethyl)formamide
CID 101077538
4-chloro-2-(difluoromethyl)-N,N-diethylquinolin-6-amine
CID 63180130
1-N,1-N-diethyl-4-fluorobenzene-1,3-diamine
CID 39237480
2-N,2-N-diethyl-8-N,8-N-dimethylphenazine-2,8-diamine
CID 46832728
N,N-diethyl-2-methylquinolin-6-amine
CID 23464022
6-N,6-N-diethyl-2-methyl-4-N-propylquinoline-4,6-diamine
CID 63483498

Frequently Asked Questions

What is the IUPAC name of 6-N,6-N-diethylquinazoline-2,4,6-triamine?
The IUPAC name of 6-N,6-N-diethylquinazoline-2,4,6-triamine (CID 44531790) is 6-N,6-N-diethylquinazoline-2,4,6-triamine.
What is the SMILES notation for 6-N,6-N-diethylquinazoline-2,4,6-triamine?
The canonical SMILES for 6-N,6-N-diethylquinazoline-2,4,6-triamine is CCN(CC)c1ccc2nc(N)nc(N)c2c1.
What is the InChIKey of 6-N,6-N-diethylquinazoline-2,4,6-triamine?
The InChIKey is OFRJUJRMWYMLFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N5/c1-3-17(4-2)8-5-6-10-9(7-8)11(13)16-12(14)15-10/h5-7H,3-4H2,1-2H3,(H4,13,14,15,16).
What are the key properties of 6-N,6-N-diethylquinazoline-2,4,6-triamine?
6-N,6-N-diethylquinazoline-2,4,6-triamine has a molecular weight of 231.30 g/mol, XLogP of 1.64, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N,6-N-diethylquinazoline-2,4,6-triamine is sourced from PubChem (CID 44531790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).