6-methoxy-4-N-methyl-2-N-(2-phenylethyl)quinazoline-2,4-diamine

C18H20N4O — CID 138683086

IUPAC6-methoxy-4-N-methyl-2-N-(2-phenylethyl)quinazoline-2,4-diamine
SMILESCNc1nc(NCCc2ccccc2)nc2ccc(OC)cc12
InChIInChI=1S/C18H20N4O/c1-19-17-15-12-14(23-2)8-9-16(15)21-18(22-17)20-11-10-13-6-4-3-5-7-13/h3-9,12H,10-11H2,1-2H3,(H2,19,20,21,22)
InChIKeyRSPHINHFOYBFJJ-UHFFFAOYSA-N
MW308.39 g/mol
LogP3.33
Rot. Bonds6

About 6-methoxy-4-N-methyl-2-N-(2-phenylethyl)quinazoline-2,4-diamine

6-methoxy-4-N-methyl-2-N-(2-phenylethyl)quinazoline-2,4-diamine (PubChem CID 138683086) has the molecular formula C18H20N4O and a molecular weight of 308.39 g/mol. Its IUPAC name is 6-methoxy-4-N-methyl-2-N-(2-phenylethyl)quinazoline-2,4-diamine.

Molecular Properties

Compound Name6-methoxy-4-N-methyl-2-N-(2-phenylethyl)quinazoline-2,4-diamine
PubChem CID138683086
Molecular FormulaC18H20N4O
Molecular Weight308.39 g/mol
Exact Mass308.16
IUPAC Name6-methoxy-4-N-methyl-2-N-(2-phenylethyl)quinazoline-2,4-diamine
SMILESCNc1nc(NCCc2ccccc2)nc2ccc(OC)cc12
InChIInChI=1S/C18H20N4O/c1-19-17-15-12-14(23-2)8-9-16(15)21-18(22-17)20-11-10-13-6-4-3-5-7-13/h3-9,12H,10-11H2,1-2H3,(H2,19,20,21,22)
InChIKeyRSPHINHFOYBFJJ-UHFFFAOYSA-N
XLogP3.33
TPSA59.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.39
LogP ≤ 53.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-chloro-4-N-methyl-2-N-(2-phenylethyl)quinazoline-2,4-diamine
CID 138683091
2-N-[2-(3-methoxyphenyl)ethyl]-4-N-propylquinazoline-2,4-diamine
CID 91966285
2-N-[2-(4-methoxyphenyl)ethyl]-6-methyl-4-N-(3-phenylpropyl)pyrimidine-2,4-diamine
CID 112921379
2-N,4-N-dibenzyl-7-methoxyquinazoline-2,4-diamine
CID 46850885
[4-[2-[(6-methoxy-2-methylquinazolin-4-yl)amino]ethyl]phenyl]methanol
CID 133434949
2-N-[2-(4-methoxyphenyl)ethyl]-4-N-(thiophen-2-ylmethyl)quinazoline-2,4-diamine
CID 91963642
2-N,4-N-bis(3-phenylpropyl)quinazoline-2,4-diamine
CID 23196584
2-N,3-N-bis[2-(4-methoxyphenyl)ethyl]quinoxaline-2,3-diamine
CID 1023772
6-methoxy-N-(3-phenylpropyl)-2-piperazin-1-ylquinazolin-4-amine
CID 44532421
7-methoxy-N-(2-phenylethyl)-2-(trifluoromethyl)quinazolin-4-amine
CID 21003694
4-N-(2,5-dimethoxyphenyl)-5-nitro-2-N-(2-phenylethyl)pyrimidine-2,4,6-triamine
CID 3773330
2-N-(4-methoxyphenyl)-4-N-methylquinazoline-2,4-diamine
CID 50947631

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-4-N-methyl-2-N-(2-phenylethyl)quinazoline-2,4-diamine?
The IUPAC name of 6-methoxy-4-N-methyl-2-N-(2-phenylethyl)quinazoline-2,4-diamine (CID 138683086) is 6-methoxy-4-N-methyl-2-N-(2-phenylethyl)quinazoline-2,4-diamine.
What is the SMILES notation for 6-methoxy-4-N-methyl-2-N-(2-phenylethyl)quinazoline-2,4-diamine?
The canonical SMILES for 6-methoxy-4-N-methyl-2-N-(2-phenylethyl)quinazoline-2,4-diamine is CNc1nc(NCCc2ccccc2)nc2ccc(OC)cc12.
What is the InChIKey of 6-methoxy-4-N-methyl-2-N-(2-phenylethyl)quinazoline-2,4-diamine?
The InChIKey is RSPHINHFOYBFJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N4O/c1-19-17-15-12-14(23-2)8-9-16(15)21-18(22-17)20-11-10-13-6-4-3-5-7-13/h3-9,12H,10-11H2,1-2H3,(H2,19,20,21,22).
What are the key properties of 6-methoxy-4-N-methyl-2-N-(2-phenylethyl)quinazoline-2,4-diamine?
6-methoxy-4-N-methyl-2-N-(2-phenylethyl)quinazoline-2,4-diamine has a molecular weight of 308.39 g/mol, XLogP of 3.33, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-4-N-methyl-2-N-(2-phenylethyl)quinazoline-2,4-diamine is sourced from PubChem (CID 138683086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).