N-(1H-indol-5-yl)-6-methoxy-7-methylquinazolin-4-amine

C18H16N4O — CID 23537228

IUPACN-(1H-indol-5-yl)-6-methoxy-7-methylquinazolin-4-amine
SMILESCOc1cc2c(Nc3ccc4[nH]ccc4c3)ncnc2cc1C
InChIInChI=1S/C18H16N4O/c1-11-7-16-14(9-17(11)23-2)18(21-10-20-16)22-13-3-4-15-12(8-13)5-6-19-15/h3-10,19H,1-2H3,(H,20,21,22)
InChIKeyMKUVEWRVSGEABN-UHFFFAOYSA-N
MW304.35 g/mol
LogP4.17
Rot. Bonds3

About N-(1H-indol-5-yl)-6-methoxy-7-methylquinazolin-4-amine

N-(1H-indol-5-yl)-6-methoxy-7-methylquinazolin-4-amine (PubChem CID 23537228) has the molecular formula C18H16N4O and a molecular weight of 304.35 g/mol. Its IUPAC name is N-(1H-indol-5-yl)-6-methoxy-7-methylquinazolin-4-amine.

Molecular Properties

Compound NameN-(1H-indol-5-yl)-6-methoxy-7-methylquinazolin-4-amine
PubChem CID23537228
Molecular FormulaC18H16N4O
Molecular Weight304.35 g/mol
Exact Mass304.13
IUPAC NameN-(1H-indol-5-yl)-6-methoxy-7-methylquinazolin-4-amine
SMILESCOc1cc2c(Nc3ccc4[nH]ccc4c3)ncnc2cc1C
InChIInChI=1S/C18H16N4O/c1-11-7-16-14(9-17(11)23-2)18(21-10-20-16)22-13-3-4-15-12(8-13)5-6-19-15/h3-10,19H,1-2H3,(H,20,21,22)
InChIKeyMKUVEWRVSGEABN-UHFFFAOYSA-N
XLogP4.17
TPSA62.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.35
LogP ≤ 54.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1H-indol-5-yl)-6,7-dimethylquinazolin-4-amine
CID 142010031
N-(1H-indol-5-yl)-6-iodo-7-methoxyquinazolin-4-amine
CID 15521323
N-(1H-indol-5-yl)-6-methoxy-7-phenylmethoxyquinazolin-4-amine;hydrochloride
CID 22030547
N-(1H-indol-5-yl)-6-methoxy-7-(3-methylsulfonylpropoxy)quinazolin-4-amine;hydrochloride
CID 22030654
6-[2-(3,5-dimethoxyphenyl)ethenyl]-N-(1H-indol-5-yl)-7-methoxyquinazolin-4-amine
CID 70245929
N-(1H-indol-5-yl)-6-methoxy-7-[3-(4-methylpiperazin-1-yl)propoxy]quinazolin-4-amine
CID 22030671
4-N-(1H-indol-5-yl)-6-N,6-N-dimethylquinazoline-4,6-diamine
CID 23366722
4-(6-chloro-2,3-dihydroindol-1-yl)-6,7-dimethoxyquinazoline;N-(1H-indol-5-yl)-6,7-dimethoxyquinazolin-4-amine
CID 161114097
N-(1H-indol-5-yl)-7-methoxy-6-[2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)ethenyl]quinazolin-4-amine
CID 70245829
N-(3-ethynyl-4-fluorophenyl)-7-methoxy-6-methylquinazolin-4-amine
CID 58172595
N-(1H-indol-6-yl)-6-methoxy-7-[2-[(2-methyl-4-pyridinyl)amino]ethoxy]quinazolin-4-amine
CID 56985158
N-(1H-indol-5-yl)-6-nitroquinazolin-4-amine;hydrochloride
CID 23366741

Frequently Asked Questions

What is the IUPAC name of N-(1H-indol-5-yl)-6-methoxy-7-methylquinazolin-4-amine?
The IUPAC name of N-(1H-indol-5-yl)-6-methoxy-7-methylquinazolin-4-amine (CID 23537228) is N-(1H-indol-5-yl)-6-methoxy-7-methylquinazolin-4-amine.
What is the SMILES notation for N-(1H-indol-5-yl)-6-methoxy-7-methylquinazolin-4-amine?
The canonical SMILES for N-(1H-indol-5-yl)-6-methoxy-7-methylquinazolin-4-amine is COc1cc2c(Nc3ccc4[nH]ccc4c3)ncnc2cc1C.
What is the InChIKey of N-(1H-indol-5-yl)-6-methoxy-7-methylquinazolin-4-amine?
The InChIKey is MKUVEWRVSGEABN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N4O/c1-11-7-16-14(9-17(11)23-2)18(21-10-20-16)22-13-3-4-15-12(8-13)5-6-19-15/h3-10,19H,1-2H3,(H,20,21,22).
What are the key properties of N-(1H-indol-5-yl)-6-methoxy-7-methylquinazolin-4-amine?
N-(1H-indol-5-yl)-6-methoxy-7-methylquinazolin-4-amine has a molecular weight of 304.35 g/mol, XLogP of 4.17, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indol-5-yl)-6-methoxy-7-methylquinazolin-4-amine is sourced from PubChem (CID 23537228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).