N-(2,5-dimethoxyphenyl)-4-morpholin-4-ylquinazolin-2-amine;hydrochloride

C20H23ClN4O3 — CID 2975510

IUPACN-(2,5-dimethoxyphenyl)-4-morpholin-4-ylquinazolin-2-amine;hydrochloride
SMILESCOc1ccc(OC)c(Nc2nc(N3CCOCC3)c3ccccc3n2)c1.Cl
InChIInChI=1S/C20H22N4O3.ClH/c1-25-14-7-8-18(26-2)17(13-14)22-20-21-16-6-4-3-5-15(16)19(23-20)24-9-11-27-12-10-24;/h3-8,13H,9-12H2,1-2H3,(H,21,22,23);1H
InChIKeyFFYVFCMCCSYGSX-UHFFFAOYSA-N
MW402.88 g/mol
LogP3.65
Rot. Bonds5

About N-(2,5-dimethoxyphenyl)-4-morpholin-4-ylquinazolin-2-amine;hydrochloride

N-(2,5-dimethoxyphenyl)-4-morpholin-4-ylquinazolin-2-amine;hydrochloride (PubChem CID 2975510) has the molecular formula C20H23ClN4O3 and a molecular weight of 402.88 g/mol. Its IUPAC name is N-(2,5-dimethoxyphenyl)-4-morpholin-4-ylquinazolin-2-amine;hydrochloride.

Molecular Properties

Compound NameN-(2,5-dimethoxyphenyl)-4-morpholin-4-ylquinazolin-2-amine;hydrochloride
PubChem CID2975510
Molecular FormulaC20H23ClN4O3
Molecular Weight402.88 g/mol
Exact Mass402.15
IUPAC NameN-(2,5-dimethoxyphenyl)-4-morpholin-4-ylquinazolin-2-amine;hydrochloride
SMILESCOc1ccc(OC)c(Nc2nc(N3CCOCC3)c3ccccc3n2)c1.Cl
InChIInChI=1S/C20H22N4O3.ClH/c1-25-14-7-8-18(26-2)17(13-14)22-20-21-16-6-4-3-5-15(16)19(23-20)24-9-11-27-12-10-24;/h3-8,13H,9-12H2,1-2H3,(H,21,22,23);1H
InChIKeyFFYVFCMCCSYGSX-UHFFFAOYSA-N
XLogP3.65
TPSA68.74 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.88
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-(2-methoxyphenyl)-4-(4-methylpiperazin-1-yl)quinazolin-2-amine
CID 769569
N-(4-methylphenyl)-4-morpholin-4-ylquinazolin-2-amine;hydrochloride
CID 2910267
ethane;N-(4-methoxyphenyl)-4-pyrrolidin-1-ylquinazolin-2-amine
CID 143177747
N-(4-methoxyphenyl)-4-piperidin-1-ylquinazolin-2-amine
CID 2095932
4-N,4-N-dimethyl-1-N-(4-morpholin-4-ylquinazolin-2-yl)benzene-1,4-diamine;hydrochloride
CID 2972487
N-(3-fluorophenyl)-4-morpholin-4-ylquinazolin-2-amine
CID 39861394
N-(2,5-dimethoxyphenyl)-6-morpholin-4-ylpyrimidin-4-amine
CID 112857127
2-[[2-(2,5-dimethoxyanilino)quinazolin-4-yl]amino]propanoic acid
CID 91964007
1-[3-[(4-morpholin-4-ylquinazolin-2-yl)amino]phenyl]ethanol
CID 50946885
N-(2-methoxy-5-methylphenyl)-4,6-dimorpholin-4-yl-1,3,5-triazin-2-amine
CID 7589328
N-(2,5-dimethoxyphenyl)-4-methylquinolin-2-amine
CID 806171
N-(2,4-dimethoxyphenyl)-4-methyl-6-morpholin-4-ylpyrimidin-2-amine
CID 112912177

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethoxyphenyl)-4-morpholin-4-ylquinazolin-2-amine;hydrochloride?
The IUPAC name of N-(2,5-dimethoxyphenyl)-4-morpholin-4-ylquinazolin-2-amine;hydrochloride (CID 2975510) is N-(2,5-dimethoxyphenyl)-4-morpholin-4-ylquinazolin-2-amine;hydrochloride.
What is the SMILES notation for N-(2,5-dimethoxyphenyl)-4-morpholin-4-ylquinazolin-2-amine;hydrochloride?
The canonical SMILES for N-(2,5-dimethoxyphenyl)-4-morpholin-4-ylquinazolin-2-amine;hydrochloride is COc1ccc(OC)c(Nc2nc(N3CCOCC3)c3ccccc3n2)c1.Cl.
What is the InChIKey of N-(2,5-dimethoxyphenyl)-4-morpholin-4-ylquinazolin-2-amine;hydrochloride?
The InChIKey is FFYVFCMCCSYGSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O3.ClH/c1-25-14-7-8-18(26-2)17(13-14)22-20-21-16-6-4-3-5-15(16)19(23-20)24-9-11-27-12-10-24;/h3-8,13H,9-12H2,1-2H3,(H,21,22,23);1H.
What are the key properties of N-(2,5-dimethoxyphenyl)-4-morpholin-4-ylquinazolin-2-amine;hydrochloride?
N-(2,5-dimethoxyphenyl)-4-morpholin-4-ylquinazolin-2-amine;hydrochloride has a molecular weight of 402.88 g/mol, XLogP of 3.65, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethoxyphenyl)-4-morpholin-4-ylquinazolin-2-amine;hydrochloride is sourced from PubChem (CID 2975510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).