3-methoxy-N-[4-(3-methyl-2-oxo-1,3-diazinan-1-yl)phenyl]benzamide

C19H21N3O3 — CID 110666844

IUPAC3-methoxy-N-[4-(3-methyl-2-oxo-1,3-diazinan-1-yl)phenyl]benzamide
SMILESCOc1cccc(C(=O)Nc2ccc(N3CCCN(C)C3=O)cc2)c1
InChIInChI=1S/C19H21N3O3/c1-21-11-4-12-22(19(21)24)16-9-7-15(8-10-16)20-18(23)14-5-3-6-17(13-14)25-2/h3,5-10,13H,4,11-12H2,1-2H3,(H,20,23)
InChIKeyCSICGPGWAJSVFD-UHFFFAOYSA-N
MW339.40 g/mol
LogP3.21
Rot. Bonds4

About 3-methoxy-N-[4-(3-methyl-2-oxo-1,3-diazinan-1-yl)phenyl]benzamide

3-methoxy-N-[4-(3-methyl-2-oxo-1,3-diazinan-1-yl)phenyl]benzamide (PubChem CID 110666844) has the molecular formula C19H21N3O3 and a molecular weight of 339.40 g/mol. Its IUPAC name is 3-methoxy-N-[4-(3-methyl-2-oxo-1,3-diazinan-1-yl)phenyl]benzamide.

Molecular Properties

Compound Name3-methoxy-N-[4-(3-methyl-2-oxo-1,3-diazinan-1-yl)phenyl]benzamide
PubChem CID110666844
Molecular FormulaC19H21N3O3
Molecular Weight339.40 g/mol
Exact Mass339.16
IUPAC Name3-methoxy-N-[4-(3-methyl-2-oxo-1,3-diazinan-1-yl)phenyl]benzamide
SMILESCOc1cccc(C(=O)Nc2ccc(N3CCCN(C)C3=O)cc2)c1
InChIInChI=1S/C19H21N3O3/c1-21-11-4-12-22(19(21)24)16-9-7-15(8-10-16)20-18(23)14-5-3-6-17(13-14)25-2/h3,5-10,13H,4,11-12H2,1-2H3,(H,20,23)
InChIKeyCSICGPGWAJSVFD-UHFFFAOYSA-N
XLogP3.21
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.40
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(3-benzyl-2-oxo-1,3-diazinan-1-yl)phenyl]-3-methoxybenzamide
CID 42849025
3-methoxy-N-[4-[3-[(2-methoxyphenyl)methyl]-2-oxo-1,3-diazinan-1-yl]phenyl]benzamide
CID 42868692
N-[4-[3-[(3,4-difluorophenyl)methyl]-2-oxo-1,3-diazinan-1-yl]phenyl]-3-methoxybenzamide
CID 46040877
N-[4-[3-[(3-methoxyphenyl)methyl]-2-oxo-1,3-diazinan-1-yl]phenyl]benzamide
CID 46156673
3-methoxy-N-(4-morpholin-4-ylphenyl)benzamide
CID 795014
3-methoxy-N-(1-methyl-3,4-dihydro-2H-quinolin-7-yl)benzamide
CID 110729116
N-(4-aminophenyl)-3-methoxybenzamide
CID 8566724
3-methoxy-N-[6-(2-oxo-3-phenylimidazolidin-1-yl)-3-pyridinyl]benzamide
CID 53187472
3-methoxy-N-[3-(2-oxopiperidin-1-yl)phenyl]benzamide
CID 7687642
3,5-dimethoxy-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 7686372
N-[4-(2-ethylpiperidin-1-yl)phenyl]-3-methoxybenzamide
CID 112985435
N-(3-methoxyphenyl)-4-[3-[(4-methylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl]benzamide
CID 50813999

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-[4-(3-methyl-2-oxo-1,3-diazinan-1-yl)phenyl]benzamide?
The IUPAC name of 3-methoxy-N-[4-(3-methyl-2-oxo-1,3-diazinan-1-yl)phenyl]benzamide (CID 110666844) is 3-methoxy-N-[4-(3-methyl-2-oxo-1,3-diazinan-1-yl)phenyl]benzamide.
What is the SMILES notation for 3-methoxy-N-[4-(3-methyl-2-oxo-1,3-diazinan-1-yl)phenyl]benzamide?
The canonical SMILES for 3-methoxy-N-[4-(3-methyl-2-oxo-1,3-diazinan-1-yl)phenyl]benzamide is COc1cccc(C(=O)Nc2ccc(N3CCCN(C)C3=O)cc2)c1.
What is the InChIKey of 3-methoxy-N-[4-(3-methyl-2-oxo-1,3-diazinan-1-yl)phenyl]benzamide?
The InChIKey is CSICGPGWAJSVFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O3/c1-21-11-4-12-22(19(21)24)16-9-7-15(8-10-16)20-18(23)14-5-3-6-17(13-14)25-2/h3,5-10,13H,4,11-12H2,1-2H3,(H,20,23).
What are the key properties of 3-methoxy-N-[4-(3-methyl-2-oxo-1,3-diazinan-1-yl)phenyl]benzamide?
3-methoxy-N-[4-(3-methyl-2-oxo-1,3-diazinan-1-yl)phenyl]benzamide has a molecular weight of 339.40 g/mol, XLogP of 3.21, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-[4-(3-methyl-2-oxo-1,3-diazinan-1-yl)phenyl]benzamide is sourced from PubChem (CID 110666844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).