6-methoxyquinazoline-4,7-diamine

C9H10N4O — CID 142061671

IUPAC6-methoxyquinazoline-4,7-diamine
SMILESCOc1cc2c(N)ncnc2cc1N
InChIInChI=1S/C9H10N4O/c1-14-8-2-5-7(3-6(8)10)12-4-13-9(5)11/h2-4H,10H2,1H3,(H2,11,12,13)
InChIKeyMJVVJQIAFWTWRV-UHFFFAOYSA-N
MW190.21 g/mol
LogP0.80
Rot. Bonds1

About 6-methoxyquinazoline-4,7-diamine

6-methoxyquinazoline-4,7-diamine (PubChem CID 142061671) has the molecular formula C9H10N4O and a molecular weight of 190.21 g/mol. Its IUPAC name is 6-methoxyquinazoline-4,7-diamine.

Molecular Properties

Compound Name6-methoxyquinazoline-4,7-diamine
PubChem CID142061671
Molecular FormulaC9H10N4O
Molecular Weight190.21 g/mol
Exact Mass190.09
IUPAC Name6-methoxyquinazoline-4,7-diamine
SMILESCOc1cc2c(N)ncnc2cc1N
InChIInChI=1S/C9H10N4O/c1-14-8-2-5-7(3-6(8)10)12-4-13-9(5)11/h2-4H,10H2,1H3,(H2,11,12,13)
InChIKeyMJVVJQIAFWTWRV-UHFFFAOYSA-N
XLogP0.80
TPSA87.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.21
LogP ≤ 50.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

4-amino-6-methoxyquinazolin-7-ol
CID 135697903
7-methoxy-6-propan-2-yloxyquinazolin-4-amine
CID 141299467
6,7-dimethylquinazolin-4-amine;ethane
CID 142177634
6-methoxy-7-N-(3-methoxypropyl)quinazoline-4,7-diamine
CID 22649202
1,3-dicyclohexylurea;6,7-dimethoxyquinazolin-4-amine
CID 174731053
6-methoxy-7-(3-piperidin-1-ylpropoxy)quinazolin-4-amine
CID 22649262
6,7-dimethoxy-4-methylquinazoline
CID 4319422
2-[4-[3-(4-amino-6-methoxyquinazolin-7-yl)oxypropyl]piperazin-1-yl]ethanol
CID 141094981
6,7-dimethoxyquinazolin-4-amine;(4-methylsulfanylphenyl)urea
CID 170764490
6,7-dimethoxyquinazolin-4-amine;(5-methylsulfanylnaphthalen-1-yl)phosphonous acid
CID 170764451
6,7-ditert-butylquinazolin-4-amine
CID 59066322
2,3-dihydro-1H-imidazo[4,5-g]quinazolin-8-amine;ethane
CID 142489177

Frequently Asked Questions

What is the IUPAC name of 6-methoxyquinazoline-4,7-diamine?
The IUPAC name of 6-methoxyquinazoline-4,7-diamine (CID 142061671) is 6-methoxyquinazoline-4,7-diamine.
What is the SMILES notation for 6-methoxyquinazoline-4,7-diamine?
The canonical SMILES for 6-methoxyquinazoline-4,7-diamine is COc1cc2c(N)ncnc2cc1N.
What is the InChIKey of 6-methoxyquinazoline-4,7-diamine?
The InChIKey is MJVVJQIAFWTWRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4O/c1-14-8-2-5-7(3-6(8)10)12-4-13-9(5)11/h2-4H,10H2,1H3,(H2,11,12,13).
What are the key properties of 6-methoxyquinazoline-4,7-diamine?
6-methoxyquinazoline-4,7-diamine has a molecular weight of 190.21 g/mol, XLogP of 0.80, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxyquinazoline-4,7-diamine is sourced from PubChem (CID 142061671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).