N-methyl-4-[(2-methyl-3-pyridinyl)oxy]quinazolin-2-amine

C15H14N4O — CID 80877986

IUPACN-methyl-4-[(2-methyl-3-pyridinyl)oxy]quinazolin-2-amine
SMILESCNc1nc(Oc2cccnc2C)c2ccccc2n1
InChIInChI=1S/C15H14N4O/c1-10-13(8-5-9-17-10)20-14-11-6-3-4-7-12(11)18-15(16-2)19-14/h3-9H,1-2H3,(H,16,18,19)
InChIKeyGMOVQCYDPWADBM-UHFFFAOYSA-N
MW266.30 g/mol
LogP3.17
Rot. Bonds3

About N-methyl-4-[(2-methyl-3-pyridinyl)oxy]quinazolin-2-amine

N-methyl-4-[(2-methyl-3-pyridinyl)oxy]quinazolin-2-amine (PubChem CID 80877986) has the molecular formula C15H14N4O and a molecular weight of 266.30 g/mol. Its IUPAC name is N-methyl-4-[(2-methyl-3-pyridinyl)oxy]quinazolin-2-amine.

Molecular Properties

Compound NameN-methyl-4-[(2-methyl-3-pyridinyl)oxy]quinazolin-2-amine
PubChem CID80877986
Molecular FormulaC15H14N4O
Molecular Weight266.30 g/mol
Exact Mass266.12
IUPAC NameN-methyl-4-[(2-methyl-3-pyridinyl)oxy]quinazolin-2-amine
SMILESCNc1nc(Oc2cccnc2C)c2ccccc2n1
InChIInChI=1S/C15H14N4O/c1-10-13(8-5-9-17-10)20-14-11-6-3-4-7-12(11)18-15(16-2)19-14/h3-9H,1-2H3,(H,16,18,19)
InChIKeyGMOVQCYDPWADBM-UHFFFAOYSA-N
XLogP3.17
TPSA59.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-4-[(2-methyl-3-pyridinyl)oxy]quinazolin-2-amine?
The IUPAC name of N-methyl-4-[(2-methyl-3-pyridinyl)oxy]quinazolin-2-amine (CID 80877986) is N-methyl-4-[(2-methyl-3-pyridinyl)oxy]quinazolin-2-amine.
What is the SMILES notation for N-methyl-4-[(2-methyl-3-pyridinyl)oxy]quinazolin-2-amine?
The canonical SMILES for N-methyl-4-[(2-methyl-3-pyridinyl)oxy]quinazolin-2-amine is CNc1nc(Oc2cccnc2C)c2ccccc2n1.
What is the InChIKey of N-methyl-4-[(2-methyl-3-pyridinyl)oxy]quinazolin-2-amine?
The InChIKey is GMOVQCYDPWADBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O/c1-10-13(8-5-9-17-10)20-14-11-6-3-4-7-12(11)18-15(16-2)19-14/h3-9H,1-2H3,(H,16,18,19).
What are the key properties of N-methyl-4-[(2-methyl-3-pyridinyl)oxy]quinazolin-2-amine?
N-methyl-4-[(2-methyl-3-pyridinyl)oxy]quinazolin-2-amine has a molecular weight of 266.30 g/mol, XLogP of 3.17, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-[(2-methyl-3-pyridinyl)oxy]quinazolin-2-amine is sourced from PubChem (CID 80877986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).