6,7,8-trimethoxy-2-N,2-N-dipropylquinazoline-2,4-diamine

C17H26N4O3 — CID 157201647

IUPAC6,7,8-trimethoxy-2-N,2-N-dipropylquinazoline-2,4-diamine
SMILESCCCN(CCC)c1nc(N)c2cc(OC)c(OC)c(OC)c2n1
InChIInChI=1S/C17H26N4O3/c1-6-8-21(9-7-2)17-19-13-11(16(18)20-17)10-12(22-3)14(23-4)15(13)24-5/h10H,6-9H2,1-5H3,(H2,18,19,20)
InChIKeyXWNXWXRUIZIHHW-UHFFFAOYSA-N
MW334.42 g/mol
LogP2.86
Rot. Bonds8

About 6,7,8-trimethoxy-2-N,2-N-dipropylquinazoline-2,4-diamine

6,7,8-trimethoxy-2-N,2-N-dipropylquinazoline-2,4-diamine (PubChem CID 157201647) has the molecular formula C17H26N4O3 and a molecular weight of 334.42 g/mol. Its IUPAC name is 6,7,8-trimethoxy-2-N,2-N-dipropylquinazoline-2,4-diamine.

Molecular Properties

Compound Name6,7,8-trimethoxy-2-N,2-N-dipropylquinazoline-2,4-diamine
PubChem CID157201647
Molecular FormulaC17H26N4O3
Molecular Weight334.42 g/mol
Exact Mass334.20
IUPAC Name6,7,8-trimethoxy-2-N,2-N-dipropylquinazoline-2,4-diamine
SMILESCCCN(CCC)c1nc(N)c2cc(OC)c(OC)c(OC)c2n1
InChIInChI=1S/C17H26N4O3/c1-6-8-21(9-7-2)17-19-13-11(16(18)20-17)10-12(22-3)14(23-4)15(13)24-5/h10H,6-9H2,1-5H3,(H2,18,19,20)
InChIKeyXWNXWXRUIZIHHW-UHFFFAOYSA-N
XLogP2.86
TPSA82.73 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.42
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

6,7-dimethoxy-2-N-[2-(methylamino)ethyl]-2-N-propylquinazoline-2,4-diamine
CID 142218261
2-bromo-6,7,8-trimethoxyquinazolin-4-amine
CID 154093660
2-[(4-amino-6,7-dimethoxyquinazolin-2-yl)-ethylamino]ethanol
CID 134103872
6-propoxy-2-N,2-N-dipropyl-1,3,5-triazine-2,4-diamine
CID 80763865
bis(6,7,8-trimethoxy-2-piperazin-1-ylquinazolin-4-amine);hydrate
CID 70479861
butyl 4-(4-amino-6,7,8-trimethoxyquinazolin-2-yl)piperazine-1-carboxylate
CID 134115334
2-N-[2-(diethylamino)ethyl]-6,7-dimethoxy-2-N-methylquinazoline-2,4-diamine
CID 134115399
2-[2-hydroxyethyl-(6,7,8-trimethoxyquinazolin-4-yl)amino]ethanol
CID 110433388
2-tert-butyl-8-fluoro-6,7-dimethoxyquinazolin-4-amine
CID 138627758
4-[(2-amino-6,7,8-trimethoxyquinazolin-4-yl)methyl]-2-methoxyphenol
CID 150058857
N'-(4,6-dimethoxypyrimidin-2-yl)-N-methyl-N'-propylethane-1,2-diamine
CID 115355574
2-methyl-4-N,4-N-dipropyl-6-N-(3,4,5-trimethoxyphenyl)pyrimidine-4,6-diamine
CID 112876701

Frequently Asked Questions

What is the IUPAC name of 6,7,8-trimethoxy-2-N,2-N-dipropylquinazoline-2,4-diamine?
The IUPAC name of 6,7,8-trimethoxy-2-N,2-N-dipropylquinazoline-2,4-diamine (CID 157201647) is 6,7,8-trimethoxy-2-N,2-N-dipropylquinazoline-2,4-diamine.
What is the SMILES notation for 6,7,8-trimethoxy-2-N,2-N-dipropylquinazoline-2,4-diamine?
The canonical SMILES for 6,7,8-trimethoxy-2-N,2-N-dipropylquinazoline-2,4-diamine is CCCN(CCC)c1nc(N)c2cc(OC)c(OC)c(OC)c2n1.
What is the InChIKey of 6,7,8-trimethoxy-2-N,2-N-dipropylquinazoline-2,4-diamine?
The InChIKey is XWNXWXRUIZIHHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N4O3/c1-6-8-21(9-7-2)17-19-13-11(16(18)20-17)10-12(22-3)14(23-4)15(13)24-5/h10H,6-9H2,1-5H3,(H2,18,19,20).
What are the key properties of 6,7,8-trimethoxy-2-N,2-N-dipropylquinazoline-2,4-diamine?
6,7,8-trimethoxy-2-N,2-N-dipropylquinazoline-2,4-diamine has a molecular weight of 334.42 g/mol, XLogP of 2.86, 8 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7,8-trimethoxy-2-N,2-N-dipropylquinazoline-2,4-diamine is sourced from PubChem (CID 157201647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).