methyl N-[4-(4-methoxy-N-methylanilino)-2-methylquinazolin-6-yl]carbamate

C19H20N4O3 — CID 11508604

IUPACmethyl N-[4-(4-methoxy-N-methylanilino)-2-methylquinazolin-6-yl]carbamate
SMILESCOC(=O)Nc1ccc2nc(C)nc(N(C)c3ccc(OC)cc3)c2c1
InChIInChI=1S/C19H20N4O3/c1-12-20-17-10-5-13(22-19(24)26-4)11-16(17)18(21-12)23(2)14-6-8-15(25-3)9-7-14/h5-11H,1-4H3,(H,22,24)
InChIKeyQLMYXXBYSOWJQN-UHFFFAOYSA-N
MW352.39 g/mol
LogP3.89
Rot. Bonds4

About methyl N-[4-(4-methoxy-N-methylanilino)-2-methylquinazolin-6-yl]carbamate

methyl N-[4-(4-methoxy-N-methylanilino)-2-methylquinazolin-6-yl]carbamate (PubChem CID 11508604) has the molecular formula C19H20N4O3 and a molecular weight of 352.39 g/mol. Its IUPAC name is methyl N-[4-(4-methoxy-N-methylanilino)-2-methylquinazolin-6-yl]carbamate.

Molecular Properties

Compound Namemethyl N-[4-(4-methoxy-N-methylanilino)-2-methylquinazolin-6-yl]carbamate
PubChem CID11508604
Molecular FormulaC19H20N4O3
Molecular Weight352.39 g/mol
Exact Mass352.15
IUPAC Namemethyl N-[4-(4-methoxy-N-methylanilino)-2-methylquinazolin-6-yl]carbamate
SMILESCOC(=O)Nc1ccc2nc(C)nc(N(C)c3ccc(OC)cc3)c2c1
InChIInChI=1S/C19H20N4O3/c1-12-20-17-10-5-13(22-19(24)26-4)11-16(17)18(21-12)23(2)14-6-8-15(25-3)9-7-14/h5-11H,1-4H3,(H,22,24)
InChIKeyQLMYXXBYSOWJQN-UHFFFAOYSA-N
XLogP3.89
TPSA76.58 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.39
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(4-methoxyphenyl)-N,2,6-trimethylquinazolin-4-amine
CID 126620624
methyl N-[[4-[methyl-(2-methylquinazolin-4-yl)amino]phenyl]carbamoylamino]carbamate
CID 59242074
4-N-(4-methoxyphenyl)-4-N,2-dimethylquinazoline-4,7-diamine
CID 46883986
methyl N-[3-(methoxycarbonylamino)-6-(4-methoxyphenyl)phenanthridin-8-yl]carbamate
CID 89468188
1-N,4-N-dimethyl-4-N-(2-methyl-6-nitroquinazolin-4-yl)benzene-1,4-diamine
CID 68515327
2-[[6-methoxy-4-(4-methoxy-N-methylanilino)quinazolin-2-yl]amino]ethanol
CID 59242122
N-hydroxy-2-[4-[methyl-(2-methylquinazolin-4-yl)amino]phenoxy]acetamide
CID 122550234
N-[4-[(4-methoxyphenyl)methylamino]-2-methylquinazolin-6-yl]propanamide
CID 123471618
N-methyl-N-[4-[methyl-(2-methylquinazolin-4-yl)amino]phenyl]acetamide
CID 11638343
N-(4-methoxyphenyl)-2-methyl-6-(N-methylanilino)pyrimidine-4-carboxamide
CID 112848508
2-[2-methoxy-5-[methyl-(2-methylquinazolin-4-yl)amino]phenoxy]-3-methylbutanamide
CID 164621719
2-chloro-N-(4-methoxyphenyl)-N-methyl-6-nitroquinazolin-4-amine
CID 11609884

Frequently Asked Questions

What is the IUPAC name of methyl N-[4-(4-methoxy-N-methylanilino)-2-methylquinazolin-6-yl]carbamate?
The IUPAC name of methyl N-[4-(4-methoxy-N-methylanilino)-2-methylquinazolin-6-yl]carbamate (CID 11508604) is methyl N-[4-(4-methoxy-N-methylanilino)-2-methylquinazolin-6-yl]carbamate.
What is the SMILES notation for methyl N-[4-(4-methoxy-N-methylanilino)-2-methylquinazolin-6-yl]carbamate?
The canonical SMILES for methyl N-[4-(4-methoxy-N-methylanilino)-2-methylquinazolin-6-yl]carbamate is COC(=O)Nc1ccc2nc(C)nc(N(C)c3ccc(OC)cc3)c2c1.
What is the InChIKey of methyl N-[4-(4-methoxy-N-methylanilino)-2-methylquinazolin-6-yl]carbamate?
The InChIKey is QLMYXXBYSOWJQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O3/c1-12-20-17-10-5-13(22-19(24)26-4)11-16(17)18(21-12)23(2)14-6-8-15(25-3)9-7-14/h5-11H,1-4H3,(H,22,24).
What are the key properties of methyl N-[4-(4-methoxy-N-methylanilino)-2-methylquinazolin-6-yl]carbamate?
methyl N-[4-(4-methoxy-N-methylanilino)-2-methylquinazolin-6-yl]carbamate has a molecular weight of 352.39 g/mol, XLogP of 3.89, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for methyl N-[4-(4-methoxy-N-methylanilino)-2-methylquinazolin-6-yl]carbamate is sourced from PubChem (CID 11508604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).