2-(7-methyl-2-pyridin-3-ylquinazolin-4-yl)oxybenzamide;molecular hydrogen

C21H18N4O2 — CID 144500825

IUPAC2-(7-methyl-2-pyridin-3-ylquinazolin-4-yl)oxybenzamide;molecular hydrogen
SMILESCc1ccc2c(Oc3ccccc3C(N)=O)nc(-c3cccnc3)nc2c1.[H][H]
InChIInChI=1S/C21H16N4O2.H2/c1-13-8-9-15-17(11-13)24-20(14-5-4-10-23-12-14)25-21(15)27-18-7-3-2-6-16(18)19(22)26;/h2-12H,1H3,(H2,22,26);1H
InChIKeyIXAJOLJPTUEVQI-UHFFFAOYSA-N
MW358.40 g/mol
LogP4.14
Rot. Bonds4

About 2-(7-methyl-2-pyridin-3-ylquinazolin-4-yl)oxybenzamide;molecular hydrogen

2-(7-methyl-2-pyridin-3-ylquinazolin-4-yl)oxybenzamide;molecular hydrogen (PubChem CID 144500825) has the molecular formula C21H18N4O2 and a molecular weight of 358.40 g/mol. Its IUPAC name is 2-(7-methyl-2-pyridin-3-ylquinazolin-4-yl)oxybenzamide;molecular hydrogen.

Molecular Properties

Compound Name2-(7-methyl-2-pyridin-3-ylquinazolin-4-yl)oxybenzamide;molecular hydrogen
PubChem CID144500825
Molecular FormulaC21H18N4O2
Molecular Weight358.40 g/mol
Exact Mass358.14
IUPAC Name2-(7-methyl-2-pyridin-3-ylquinazolin-4-yl)oxybenzamide;molecular hydrogen
SMILESCc1ccc2c(Oc3ccccc3C(N)=O)nc(-c3cccnc3)nc2c1.[H][H]
InChIInChI=1S/C21H16N4O2.H2/c1-13-8-9-15-17(11-13)24-20(14-5-4-10-23-12-14)25-21(15)27-18-7-3-2-6-16(18)19(22)26;/h2-12H,1H3,(H2,22,26);1H
InChIKeyIXAJOLJPTUEVQI-UHFFFAOYSA-N
XLogP4.14
TPSA90.99 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.40
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[2-pyridin-3-yl-7-(trifluoromethoxy)quinazolin-4-yl]oxybenzamide
CID 71273564
7-methyl-2-pyridin-3-ylquinazolin-4-amine
CID 90989362
2-[(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)amino]-4-methylbenzamide
CID 144501294
2-pyridin-3-yl-4-pyridin-3-yloxyquinazoline
CID 4793706
2-[(8-methoxy-6-methyl-2-pyridin-3-ylquinazolin-4-yl)amino]benzamide
CID 144501322
2-(3-methylphenoxy)benzamide
CID 70968841
2-[[7-(2,4-difluorophenyl)-2-pyridin-3-ylquinazolin-4-yl]amino]benzamide
CID 71181221
4-phenoxy-2-pyridin-3-ylquinazolin-6-ol
CID 71274335
2-pyridin-3-yl-4-(2,3,5,6-tetrafluorophenoxy)quinazoline
CID 9106981
2-[(6-hydroxy-2-pyridin-3-ylquinazolin-4-yl)amino]benzamide
CID 67297950
2-(5-bromo-2-chloropyrimidin-4-yl)oxybenzamide
CID 79076427
5-methyl-3-[3-(2-pyridin-3-ylquinazolin-4-yl)oxyphenyl]-1,2,4-oxadiazole
CID 60503325

Frequently Asked Questions

What is the IUPAC name of 2-(7-methyl-2-pyridin-3-ylquinazolin-4-yl)oxybenzamide;molecular hydrogen?
The IUPAC name of 2-(7-methyl-2-pyridin-3-ylquinazolin-4-yl)oxybenzamide;molecular hydrogen (CID 144500825) is 2-(7-methyl-2-pyridin-3-ylquinazolin-4-yl)oxybenzamide;molecular hydrogen.
What is the SMILES notation for 2-(7-methyl-2-pyridin-3-ylquinazolin-4-yl)oxybenzamide;molecular hydrogen?
The canonical SMILES for 2-(7-methyl-2-pyridin-3-ylquinazolin-4-yl)oxybenzamide;molecular hydrogen is Cc1ccc2c(Oc3ccccc3C(N)=O)nc(-c3cccnc3)nc2c1.[H][H].
What is the InChIKey of 2-(7-methyl-2-pyridin-3-ylquinazolin-4-yl)oxybenzamide;molecular hydrogen?
The InChIKey is IXAJOLJPTUEVQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16N4O2.H2/c1-13-8-9-15-17(11-13)24-20(14-5-4-10-23-12-14)25-21(15)27-18-7-3-2-6-16(18)19(22)26;/h2-12H,1H3,(H2,22,26);1H.
What are the key properties of 2-(7-methyl-2-pyridin-3-ylquinazolin-4-yl)oxybenzamide;molecular hydrogen?
2-(7-methyl-2-pyridin-3-ylquinazolin-4-yl)oxybenzamide;molecular hydrogen has a molecular weight of 358.40 g/mol, XLogP of 4.14, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(7-methyl-2-pyridin-3-ylquinazolin-4-yl)oxybenzamide;molecular hydrogen is sourced from PubChem (CID 144500825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).