N-[(2-ethoxyphenyl)methyl]-2-methylquinazolin-4-amine

C18H19N3O — CID 68649031

IUPACN-[(2-ethoxyphenyl)methyl]-2-methylquinazolin-4-amine
SMILESCCOc1ccccc1CNc1nc(C)nc2ccccc12
InChIInChI=1S/C18H19N3O/c1-3-22-17-11-7-4-8-14(17)12-19-18-15-9-5-6-10-16(15)20-13(2)21-18/h4-11H,3,12H2,1-2H3,(H,19,20,21)
InChIKeyCZLRWQJFOQVMEC-UHFFFAOYSA-N
MW293.37 g/mol
LogP3.95
Rot. Bonds5

About N-[(2-ethoxyphenyl)methyl]-2-methylquinazolin-4-amine

N-[(2-ethoxyphenyl)methyl]-2-methylquinazolin-4-amine (PubChem CID 68649031) has the molecular formula C18H19N3O and a molecular weight of 293.37 g/mol. Its IUPAC name is N-[(2-ethoxyphenyl)methyl]-2-methylquinazolin-4-amine.

Molecular Properties

Compound NameN-[(2-ethoxyphenyl)methyl]-2-methylquinazolin-4-amine
PubChem CID68649031
Molecular FormulaC18H19N3O
Molecular Weight293.37 g/mol
Exact Mass293.15
IUPAC NameN-[(2-ethoxyphenyl)methyl]-2-methylquinazolin-4-amine
SMILESCCOc1ccccc1CNc1nc(C)nc2ccccc12
InChIInChI=1S/C18H19N3O/c1-3-22-17-11-7-4-8-14(17)12-19-18-15-9-5-6-10-16(15)20-13(2)21-18/h4-11H,3,12H2,1-2H3,(H,19,20,21)
InChIKeyCZLRWQJFOQVMEC-UHFFFAOYSA-N
XLogP3.95
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2-ethoxyphenyl)methyl]-3,6-dimethylpyrazin-2-amine
CID 133468436
2-methyl-N-(pyridin-2-ylmethyl)quinazolin-4-amine chloride
CID 53346777
N-[(2-ethoxyphenyl)methyl]quinolin-3-amine
CID 43691162
4-N-[(2-methoxyphenyl)methyl]-2-N,2-N-dimethylquinazoline-2,4-diamine
CID 91963294
2-(4-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]quinazolin-4-amine
CID 20963119
2-N-cyclopentyl-4-N-[(2-methoxyphenyl)methyl]quinazoline-2,4-diamine
CID 91963368
N-[(2-ethoxyphenyl)methyl]-2-methyl-1,3-benzothiazol-6-amine
CID 43231044
2-N-[(2-ethoxyphenyl)methyl]-5-N-(4-methylphenyl)pyrido[4,3-d]pyrimidine-2,5-diamine
CID 161268005
N-[(3-fluorophenyl)methyl]-2-methylquinazolin-4-amine
CID 69221219
2-N-(2-methoxy-5-methylphenyl)-4-N-[(2-methoxyphenyl)methyl]quinazoline-2,4-diamine
CID 91963270
2-N-[(2-methoxyphenyl)methyl]-4-N-(thiophen-2-ylmethyl)quinazoline-2,4-diamine
CID 91963631
ethyl 4-[(2-ethoxyphenyl)methylamino]-[1]benzofuro[3,2-d]pyrimidine-2-carboxylate
CID 20971693

Frequently Asked Questions

What is the IUPAC name of N-[(2-ethoxyphenyl)methyl]-2-methylquinazolin-4-amine?
The IUPAC name of N-[(2-ethoxyphenyl)methyl]-2-methylquinazolin-4-amine (CID 68649031) is N-[(2-ethoxyphenyl)methyl]-2-methylquinazolin-4-amine.
What is the SMILES notation for N-[(2-ethoxyphenyl)methyl]-2-methylquinazolin-4-amine?
The canonical SMILES for N-[(2-ethoxyphenyl)methyl]-2-methylquinazolin-4-amine is CCOc1ccccc1CNc1nc(C)nc2ccccc12.
What is the InChIKey of N-[(2-ethoxyphenyl)methyl]-2-methylquinazolin-4-amine?
The InChIKey is CZLRWQJFOQVMEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O/c1-3-22-17-11-7-4-8-14(17)12-19-18-15-9-5-6-10-16(15)20-13(2)21-18/h4-11H,3,12H2,1-2H3,(H,19,20,21).
What are the key properties of N-[(2-ethoxyphenyl)methyl]-2-methylquinazolin-4-amine?
N-[(2-ethoxyphenyl)methyl]-2-methylquinazolin-4-amine has a molecular weight of 293.37 g/mol, XLogP of 3.95, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-ethoxyphenyl)methyl]-2-methylquinazolin-4-amine is sourced from PubChem (CID 68649031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).