2-chloro-6,7-dimethoxy-N-pyridin-2-ylquinazolin-4-amine

C15H13ClN4O2 — CID 22692875

IUPAC2-chloro-6,7-dimethoxy-N-pyridin-2-ylquinazolin-4-amine
SMILESCOc1cc2nc(Cl)nc(Nc3ccccn3)c2cc1OC
InChIInChI=1S/C15H13ClN4O2/c1-21-11-7-9-10(8-12(11)22-2)18-15(16)20-14(9)19-13-5-3-4-6-17-13/h3-8H,1-2H3,(H,17,18,19,20)
InChIKeyJNHCKGUWJJNEPR-UHFFFAOYSA-N
MW316.75 g/mol
LogP3.44
Rot. Bonds4

About 2-chloro-6,7-dimethoxy-N-pyridin-2-ylquinazolin-4-amine

2-chloro-6,7-dimethoxy-N-pyridin-2-ylquinazolin-4-amine (PubChem CID 22692875) has the molecular formula C15H13ClN4O2 and a molecular weight of 316.75 g/mol. Its IUPAC name is 2-chloro-6,7-dimethoxy-N-pyridin-2-ylquinazolin-4-amine.

Molecular Properties

Compound Name2-chloro-6,7-dimethoxy-N-pyridin-2-ylquinazolin-4-amine
PubChem CID22692875
Molecular FormulaC15H13ClN4O2
Molecular Weight316.75 g/mol
Exact Mass316.07
IUPAC Name2-chloro-6,7-dimethoxy-N-pyridin-2-ylquinazolin-4-amine
SMILESCOc1cc2nc(Cl)nc(Nc3ccccn3)c2cc1OC
InChIInChI=1S/C15H13ClN4O2/c1-21-11-7-9-10(8-12(11)22-2)18-15(16)20-14(9)19-13-5-3-4-6-17-13/h3-8H,1-2H3,(H,17,18,19,20)
InChIKeyJNHCKGUWJJNEPR-UHFFFAOYSA-N
XLogP3.44
TPSA69.16 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.75
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-N-(2-chloro-6,7-dimethoxyquinazolin-4-yl)-1-N-phenylbenzene-1,4-diamine
CID 22693012
N-(4-tert-butylphenyl)-2-chloro-6,7-dimethoxyquinazolin-4-amine
CID 22693257
2-chloro-N-(4-fluorophenyl)-6,7-dimethoxyquinazolin-4-amine
CID 22692700
2-chloro-6,7-dimethoxy-N-(3,4,5-trimethoxyphenyl)quinazolin-4-amine;hydrochloride
CID 45262047
N-benzhydryl-2-chloro-6,7-dimethoxyquinazolin-4-amine
CID 22693150
4-[(2-chloro-6,7-dimethoxyquinazolin-4-yl)amino]benzonitrile
CID 169095838
2-[(2-chloro-6,7-dimethoxyquinazolin-4-yl)amino]-4-methylphenol
CID 22692956
6,7-dimethoxy-4-N-phenyl-2-N-pyrimidin-2-ylquinazoline-2,4-diamine
CID 117087219
3-[(2-chloro-6,7-dimethoxyquinazolin-4-yl)amino]benzonitrile
CID 22693255
2-chloro-6-ethoxy-7-methoxy-N-methylquinazolin-4-amine
CID 114693438
2-chloro-N-cyclopentyl-6,7-dimethoxyquinazolin-4-amine
CID 22692592
2-chloro-N-(2-chloro-4,6-dimethylphenyl)-6,7-dimethoxyquinazolin-4-amine
CID 22692713

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6,7-dimethoxy-N-pyridin-2-ylquinazolin-4-amine?
The IUPAC name of 2-chloro-6,7-dimethoxy-N-pyridin-2-ylquinazolin-4-amine (CID 22692875) is 2-chloro-6,7-dimethoxy-N-pyridin-2-ylquinazolin-4-amine.
What is the SMILES notation for 2-chloro-6,7-dimethoxy-N-pyridin-2-ylquinazolin-4-amine?
The canonical SMILES for 2-chloro-6,7-dimethoxy-N-pyridin-2-ylquinazolin-4-amine is COc1cc2nc(Cl)nc(Nc3ccccn3)c2cc1OC.
What is the InChIKey of 2-chloro-6,7-dimethoxy-N-pyridin-2-ylquinazolin-4-amine?
The InChIKey is JNHCKGUWJJNEPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClN4O2/c1-21-11-7-9-10(8-12(11)22-2)18-15(16)20-14(9)19-13-5-3-4-6-17-13/h3-8H,1-2H3,(H,17,18,19,20).
What are the key properties of 2-chloro-6,7-dimethoxy-N-pyridin-2-ylquinazolin-4-amine?
2-chloro-6,7-dimethoxy-N-pyridin-2-ylquinazolin-4-amine has a molecular weight of 316.75 g/mol, XLogP of 3.44, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6,7-dimethoxy-N-pyridin-2-ylquinazolin-4-amine is sourced from PubChem (CID 22692875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).