N-(6,7-dimethoxyquinazolin-4-yl)-N',N'-diethylethane-1,2-diamine

C16H24N4O2 — CID 21002974

IUPACN-(6,7-dimethoxyquinazolin-4-yl)-N',N'-diethylethane-1,2-diamine
SMILESCCN(CC)CCNc1ncnc2cc(OC)c(OC)cc12
InChIInChI=1S/C16H24N4O2/c1-5-20(6-2)8-7-17-16-12-9-14(21-3)15(22-4)10-13(12)18-11-19-16/h9-11H,5-8H2,1-4H3,(H,17,18,19)
InChIKeyHRDICVBQQBGHTP-UHFFFAOYSA-N
MW304.39 g/mol
LogP2.40
Rot. Bonds8

About N-(6,7-dimethoxyquinazolin-4-yl)-N',N'-diethylethane-1,2-diamine

N-(6,7-dimethoxyquinazolin-4-yl)-N',N'-diethylethane-1,2-diamine (PubChem CID 21002974) has the molecular formula C16H24N4O2 and a molecular weight of 304.39 g/mol. Its IUPAC name is N-(6,7-dimethoxyquinazolin-4-yl)-N',N'-diethylethane-1,2-diamine.

Molecular Properties

Compound NameN-(6,7-dimethoxyquinazolin-4-yl)-N',N'-diethylethane-1,2-diamine
PubChem CID21002974
Molecular FormulaC16H24N4O2
Molecular Weight304.39 g/mol
Exact Mass304.19
IUPAC NameN-(6,7-dimethoxyquinazolin-4-yl)-N',N'-diethylethane-1,2-diamine
SMILESCCN(CC)CCNc1ncnc2cc(OC)c(OC)cc12
InChIInChI=1S/C16H24N4O2/c1-5-20(6-2)8-7-17-16-12-9-14(21-3)15(22-4)10-13(12)18-11-19-16/h9-11H,5-8H2,1-4H3,(H,17,18,19)
InChIKeyHRDICVBQQBGHTP-UHFFFAOYSA-N
XLogP2.40
TPSA59.51 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N',N'-diethyl-N-(6-iodoquinazolin-4-yl)ethane-1,2-diamine
CID 23734239
N',N'-diethyl-N-(7-methoxyquinazolin-4-yl)butane-1,4-diamine
CID 21003124
N-[4-[[6-[2-(diethylamino)ethoxy]-7-methoxyquinazolin-4-yl]amino]phenyl]acetamide
CID 129010594
N',N'-diethyl-N-(6-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)ethane-1,2-diamine
CID 110430242
N-(6,7-dimethoxyquinolin-4-yl)-N',N'-diethylpropane-1,3-diamine
CID 86037171
N-[(4-fluorophenyl)methyl]-6,7-dimethoxyquinazolin-4-amine
CID 1474879
2-[2-(diethylamino)ethylamino]-6,7-dimethoxy-3H-quinazolin-4-one
CID 137303948
4-N-[1-(butylamino)ethenyl]-1-N-[7-[2-(diethylamino)ethoxy]-6-methoxyquinazolin-4-yl]benzene-1,4-diamine
CID 168926826
ethyl N-[4-[[6-[2-(diethylamino)ethoxy]-7-methoxyquinazolin-4-yl]amino]phenyl]carbamate
CID 129010598
7-methoxy-4-(3-phosphanylpropylamino)quinazolin-6-ol
CID 59068661
6,7-dimethoxy-N-(methylideneamino)quinazolin-4-amine
CID 68596713
6,7-dimethoxy-N-(2-propylphenyl)quinazolin-4-amine
CID 68916243

Frequently Asked Questions

What is the IUPAC name of N-(6,7-dimethoxyquinazolin-4-yl)-N',N'-diethylethane-1,2-diamine?
The IUPAC name of N-(6,7-dimethoxyquinazolin-4-yl)-N',N'-diethylethane-1,2-diamine (CID 21002974) is N-(6,7-dimethoxyquinazolin-4-yl)-N',N'-diethylethane-1,2-diamine.
What is the SMILES notation for N-(6,7-dimethoxyquinazolin-4-yl)-N',N'-diethylethane-1,2-diamine?
The canonical SMILES for N-(6,7-dimethoxyquinazolin-4-yl)-N',N'-diethylethane-1,2-diamine is CCN(CC)CCNc1ncnc2cc(OC)c(OC)cc12.
What is the InChIKey of N-(6,7-dimethoxyquinazolin-4-yl)-N',N'-diethylethane-1,2-diamine?
The InChIKey is HRDICVBQQBGHTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O2/c1-5-20(6-2)8-7-17-16-12-9-14(21-3)15(22-4)10-13(12)18-11-19-16/h9-11H,5-8H2,1-4H3,(H,17,18,19).
What are the key properties of N-(6,7-dimethoxyquinazolin-4-yl)-N',N'-diethylethane-1,2-diamine?
N-(6,7-dimethoxyquinazolin-4-yl)-N',N'-diethylethane-1,2-diamine has a molecular weight of 304.39 g/mol, XLogP of 2.40, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6,7-dimethoxyquinazolin-4-yl)-N',N'-diethylethane-1,2-diamine is sourced from PubChem (CID 21002974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).