N-ethyl-3-methyl-2-[(4-methylquinazolin-2-yl)methoxy]benzamide

C20H21N3O2 — CID 126775016

IUPACN-ethyl-3-methyl-2-[(4-methylquinazolin-2-yl)methoxy]benzamide
SMILESCCNC(=O)c1cccc(C)c1OCc1nc(C)c2ccccc2n1
InChIInChI=1S/C20H21N3O2/c1-4-21-20(24)16-10-7-8-13(2)19(16)25-12-18-22-14(3)15-9-5-6-11-17(15)23-18/h5-11H,4,12H2,1-3H3,(H,21,24)
InChIKeyQSBZBIOJERSOAL-UHFFFAOYSA-N
MW335.41 g/mol
LogP3.58
Rot. Bonds5

About N-ethyl-3-methyl-2-[(4-methylquinazolin-2-yl)methoxy]benzamide

N-ethyl-3-methyl-2-[(4-methylquinazolin-2-yl)methoxy]benzamide (PubChem CID 126775016) has the molecular formula C20H21N3O2 and a molecular weight of 335.41 g/mol. Its IUPAC name is N-ethyl-3-methyl-2-[(4-methylquinazolin-2-yl)methoxy]benzamide.

Molecular Properties

Compound NameN-ethyl-3-methyl-2-[(4-methylquinazolin-2-yl)methoxy]benzamide
PubChem CID126775016
Molecular FormulaC20H21N3O2
Molecular Weight335.41 g/mol
Exact Mass335.16
IUPAC NameN-ethyl-3-methyl-2-[(4-methylquinazolin-2-yl)methoxy]benzamide
SMILESCCNC(=O)c1cccc(C)c1OCc1nc(C)c2ccccc2n1
InChIInChI=1S/C20H21N3O2/c1-4-21-20(24)16-10-7-8-13(2)19(16)25-12-18-22-14(3)15-9-5-6-11-17(15)23-18/h5-11H,4,12H2,1-3H3,(H,21,24)
InChIKeyQSBZBIOJERSOAL-UHFFFAOYSA-N
XLogP3.58
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.41
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-4-methylquinazoline-2-carboxamide
CID 14528198
N-ethyl-2,4-dimethylquinazoline-8-carboxamide
CID 159532273
ethane;N-ethylnaphthalene-1-carboxamide;propane
CID 144944456
ethyl 4-[(4-methylquinazolin-2-yl)methoxy]benzoate
CID 112816009
N-ethyl-2-iodo-3-methylbenzamide
CID 69076024
2-(dimethylamino)-N-ethylquinoline-4-carboxamide
CID 53016631
4-methyl-2-propylquinazoline
CID 102028335
N-ethyl-8-methylnaphthalene-1-carboxamide
CID 21338721
2-[[(2S)-2-(2,6-dimethylphenoxy)propanoyl]amino]-N-ethylbenzamide
CID 9297715
N-ethyl-2-pyridin-2-ylquinoline-4-carboxamide
CID 17473754
N-ethyl-2-methyl-3-(2-methylphenyl)benzamide
CID 162214048
1-ethyl-3-(quinoline-5-carbonylamino)urea
CID 75417515

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-methyl-2-[(4-methylquinazolin-2-yl)methoxy]benzamide?
The IUPAC name of N-ethyl-3-methyl-2-[(4-methylquinazolin-2-yl)methoxy]benzamide (CID 126775016) is N-ethyl-3-methyl-2-[(4-methylquinazolin-2-yl)methoxy]benzamide.
What is the SMILES notation for N-ethyl-3-methyl-2-[(4-methylquinazolin-2-yl)methoxy]benzamide?
The canonical SMILES for N-ethyl-3-methyl-2-[(4-methylquinazolin-2-yl)methoxy]benzamide is CCNC(=O)c1cccc(C)c1OCc1nc(C)c2ccccc2n1.
What is the InChIKey of N-ethyl-3-methyl-2-[(4-methylquinazolin-2-yl)methoxy]benzamide?
The InChIKey is QSBZBIOJERSOAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3O2/c1-4-21-20(24)16-10-7-8-13(2)19(16)25-12-18-22-14(3)15-9-5-6-11-17(15)23-18/h5-11H,4,12H2,1-3H3,(H,21,24).
What are the key properties of N-ethyl-3-methyl-2-[(4-methylquinazolin-2-yl)methoxy]benzamide?
N-ethyl-3-methyl-2-[(4-methylquinazolin-2-yl)methoxy]benzamide has a molecular weight of 335.41 g/mol, XLogP of 3.58, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-methyl-2-[(4-methylquinazolin-2-yl)methoxy]benzamide is sourced from PubChem (CID 126775016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).