N-methyl-4-quinazolin-4-yloxyaniline

C15H13N3O — CID 61027989

IUPACN-methyl-4-quinazolin-4-yloxyaniline
SMILESCNc1ccc(Oc2ncnc3ccccc23)cc1
InChIInChI=1S/C15H13N3O/c1-16-11-6-8-12(9-7-11)19-15-13-4-2-3-5-14(13)17-10-18-15/h2-10,16H,1H3
InChIKeyRPIKZJMMFYRFSO-UHFFFAOYSA-N
MW251.29 g/mol
LogP3.46
Rot. Bonds3

About N-methyl-4-quinazolin-4-yloxyaniline

N-methyl-4-quinazolin-4-yloxyaniline (PubChem CID 61027989) has the molecular formula C15H13N3O and a molecular weight of 251.29 g/mol. Its IUPAC name is N-methyl-4-quinazolin-4-yloxyaniline.

Molecular Properties

Compound NameN-methyl-4-quinazolin-4-yloxyaniline
PubChem CID61027989
Molecular FormulaC15H13N3O
Molecular Weight251.29 g/mol
Exact Mass251.11
IUPAC NameN-methyl-4-quinazolin-4-yloxyaniline
SMILESCNc1ccc(Oc2ncnc3ccccc23)cc1
InChIInChI=1S/C15H13N3O/c1-16-11-6-8-12(9-7-11)19-15-13-4-2-3-5-14(13)17-10-18-15/h2-10,16H,1H3
InChIKeyRPIKZJMMFYRFSO-UHFFFAOYSA-N
XLogP3.46
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.29
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-4-quinazolin-4-yloxyaniline
CID 60895454
4-naphthalen-2-yloxyquinazoline
CID 31538161
4-quinazolin-4-yloxybenzoic acid
CID 61395638
3-methyl-N-(4-quinazolin-4-yloxyphenyl)benzamide
CID 24661832
N-methyl-4-(5-methylpyrrolo[3,2-d]pyrimidin-4-yl)oxyaniline
CID 143388806
4-quinoxalin-6-yloxyquinazoline
CID 133406622
4-(4-pyrazol-1-ylphenoxy)quinazoline
CID 138038739
4-(2-chlorophenoxy)quinazoline
CID 31538122
4-ethoxyquinazoline
CID 589708
quinazolin-4-yl hypofluorite
CID 143671515
ethyl N-(3-quinazolin-4-yloxyphenyl)carbamate
CID 31538412
3-bromo-5-quinazolin-4-yloxyaniline
CID 103589063

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-quinazolin-4-yloxyaniline?
The IUPAC name of N-methyl-4-quinazolin-4-yloxyaniline (CID 61027989) is N-methyl-4-quinazolin-4-yloxyaniline.
What is the SMILES notation for N-methyl-4-quinazolin-4-yloxyaniline?
The canonical SMILES for N-methyl-4-quinazolin-4-yloxyaniline is CNc1ccc(Oc2ncnc3ccccc23)cc1.
What is the InChIKey of N-methyl-4-quinazolin-4-yloxyaniline?
The InChIKey is RPIKZJMMFYRFSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O/c1-16-11-6-8-12(9-7-11)19-15-13-4-2-3-5-14(13)17-10-18-15/h2-10,16H,1H3.
What are the key properties of N-methyl-4-quinazolin-4-yloxyaniline?
N-methyl-4-quinazolin-4-yloxyaniline has a molecular weight of 251.29 g/mol, XLogP of 3.46, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-quinazolin-4-yloxyaniline is sourced from PubChem (CID 61027989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).