(2R)-2-(2-methoxyphenyl)-2-[(2-methyl-[1,2,4]triazolo[1,5-c]quinazolin-5-yl)amino]ethanol

C19H19N5O2 — CID 95628902

IUPAC(2R)-2-(2-methoxyphenyl)-2-[(2-methyl-[1,2,4]triazolo[1,5-c]quinazolin-5-yl)amino]ethanol
SMILESCOc1ccccc1[C@H](CO)Nc1nc2ccccc2c2nc(C)nn12
InChIInChI=1S/C19H19N5O2/c1-12-20-18-14-8-3-5-9-15(14)21-19(24(18)23-12)22-16(11-25)13-7-4-6-10-17(13)26-2/h3-10,16,25H,11H2,1-2H3,(H,21,22)/t16-/m0/s1
InChIKeySZZDEQWTOFYUAT-INIZCTEOSA-N
MW349.39 g/mol
LogP2.74
Rot. Bonds5

About (2R)-2-(2-methoxyphenyl)-2-[(2-methyl-[1,2,4]triazolo[1,5-c]quinazolin-5-yl)amino]ethanol

(2R)-2-(2-methoxyphenyl)-2-[(2-methyl-[1,2,4]triazolo[1,5-c]quinazolin-5-yl)amino]ethanol (PubChem CID 95628902) has the molecular formula C19H19N5O2 and a molecular weight of 349.39 g/mol. Its IUPAC name is (2R)-2-(2-methoxyphenyl)-2-[(2-methyl-[1,2,4]triazolo[1,5-c]quinazolin-5-yl)amino]ethanol.

Molecular Properties

Compound Name(2R)-2-(2-methoxyphenyl)-2-[(2-methyl-[1,2,4]triazolo[1,5-c]quinazolin-5-yl)amino]ethanol
PubChem CID95628902
Molecular FormulaC19H19N5O2
Molecular Weight349.39 g/mol
Exact Mass349.15
IUPAC Name(2R)-2-(2-methoxyphenyl)-2-[(2-methyl-[1,2,4]triazolo[1,5-c]quinazolin-5-yl)amino]ethanol
SMILESCOc1ccccc1[C@H](CO)Nc1nc2ccccc2c2nc(C)nn12
InChIInChI=1S/C19H19N5O2/c1-12-20-18-14-8-3-5-9-15(14)21-19(24(18)23-12)22-16(11-25)13-7-4-6-10-17(13)26-2/h3-10,16,25H,11H2,1-2H3,(H,21,22)/t16-/m0/s1
InChIKeySZZDEQWTOFYUAT-INIZCTEOSA-N
XLogP2.74
TPSA84.57 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.39
LogP ≤ 52.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze (2R)-2-(2-methoxyphenyl)-2-[(2-methyl-[1,2,4]triazolo[1,5-c]quinazolin-5-yl)amino]ethanol with MolForge

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Related Compounds

2-(2-methoxyphenyl)-2-(2-methylanilino)ethanol
CID 61047526
8,9-dimethoxy-2-methyl-N-propan-2-yl-[1,2,4]triazolo[1,5-c]quinazolin-5-amine
CID 54383188
1-(2,3-dichlorophenoxy)-3-[(2-methyl-[1,2,4]triazolo[1,5-c]quinazolin-5-yl)amino]propan-2-ol
CID 56574406
2-[(2-methyl-[1,2,4]triazolo[1,5-c]quinazolin-5-yl)sulfanyl]ethanol
CID 16584695
N-cycloheptyl-2-methyl-[1,2,4]triazolo[1,5-c]quinazolin-5-amine
CID 56553711
1-(3,4-dimethoxyphenyl)-2-[(2-methyl-[1,2,4]triazolo[1,5-c]quinazolin-5-yl)sulfanyl]ethanone
CID 16582127
2-methyl-N-(4-methylcyclohexyl)-[1,2,4]triazolo[1,5-c]quinazolin-5-amine
CID 56553341
2-methyl-5-propan-2-yl-[1,2,4]triazolo[1,5-c]quinazoline
CID 58208554
3-methyl-1-N-(2-methyl-[1,2,4]triazolo[1,5-c]quinazolin-5-yl)-2-N,2-N-bis(prop-2-enyl)butane-1,2-diamine
CID 56553909
N-butan-2-yl-4-[2-(2-methyl-[1,2,4]triazolo[1,5-c]quinazolin-5-yl)hydrazinyl]-4-oxobutanamide
CID 12004909
5-[3-(4-methoxyphenoxy)propylsulfanyl]-2-methyl-[1,2,4]triazolo[1,5-c]quinazoline
CID 24601166
2-(2,3-dimethoxyphenyl)-4-[(2-methyl-[1,2,4]triazolo[1,5-c]quinazolin-5-yl)sulfanylmethyl]-1,3-thiazole
CID 46683827

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(2-methoxyphenyl)-2-[(2-methyl-[1,2,4]triazolo[1,5-c]quinazolin-5-yl)amino]ethanol?
The IUPAC name of (2R)-2-(2-methoxyphenyl)-2-[(2-methyl-[1,2,4]triazolo[1,5-c]quinazolin-5-yl)amino]ethanol (CID 95628902) is (2R)-2-(2-methoxyphenyl)-2-[(2-methyl-[1,2,4]triazolo[1,5-c]quinazolin-5-yl)amino]ethanol.
What is the SMILES notation for (2R)-2-(2-methoxyphenyl)-2-[(2-methyl-[1,2,4]triazolo[1,5-c]quinazolin-5-yl)amino]ethanol?
The canonical SMILES for (2R)-2-(2-methoxyphenyl)-2-[(2-methyl-[1,2,4]triazolo[1,5-c]quinazolin-5-yl)amino]ethanol is COc1ccccc1[C@H](CO)Nc1nc2ccccc2c2nc(C)nn12.
What is the InChIKey of (2R)-2-(2-methoxyphenyl)-2-[(2-methyl-[1,2,4]triazolo[1,5-c]quinazolin-5-yl)amino]ethanol?
The InChIKey is SZZDEQWTOFYUAT-INIZCTEOSA-N. The full InChI is InChI=1S/C19H19N5O2/c1-12-20-18-14-8-3-5-9-15(14)21-19(24(18)23-12)22-16(11-25)13-7-4-6-10-17(13)26-2/h3-10,16,25H,11H2,1-2H3,(H,21,22)/t16-/m0/s1.
What are the key properties of (2R)-2-(2-methoxyphenyl)-2-[(2-methyl-[1,2,4]triazolo[1,5-c]quinazolin-5-yl)amino]ethanol?
(2R)-2-(2-methoxyphenyl)-2-[(2-methyl-[1,2,4]triazolo[1,5-c]quinazolin-5-yl)amino]ethanol has a molecular weight of 349.39 g/mol, XLogP of 2.74, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(2-methoxyphenyl)-2-[(2-methyl-[1,2,4]triazolo[1,5-c]quinazolin-5-yl)amino]ethanol is sourced from PubChem (CID 95628902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).