3,4-dimethoxy-N-(4-pyridin-3-yloxyphenyl)benzamide

C20H18N2O4 — CID 90643074

IUPAC3,4-dimethoxy-N-(4-pyridin-3-yloxyphenyl)benzamide
SMILESCOc1ccc(C(=O)Nc2ccc(Oc3cccnc3)cc2)cc1OC
InChIInChI=1S/C20H18N2O4/c1-24-18-10-5-14(12-19(18)25-2)20(23)22-15-6-8-16(9-7-15)26-17-4-3-11-21-13-17/h3-13H,1-2H3,(H,22,23)
InChIKeyCIHVIWFSMBRRSK-UHFFFAOYSA-N
MW350.37 g/mol
LogP4.14
Rot. Bonds6

About 3,4-dimethoxy-N-(4-pyridin-3-yloxyphenyl)benzamide

3,4-dimethoxy-N-(4-pyridin-3-yloxyphenyl)benzamide (PubChem CID 90643074) has the molecular formula C20H18N2O4 and a molecular weight of 350.37 g/mol. Its IUPAC name is 3,4-dimethoxy-N-(4-pyridin-3-yloxyphenyl)benzamide.

Molecular Properties

Compound Name3,4-dimethoxy-N-(4-pyridin-3-yloxyphenyl)benzamide
PubChem CID90643074
Molecular FormulaC20H18N2O4
Molecular Weight350.37 g/mol
Exact Mass350.13
IUPAC Name3,4-dimethoxy-N-(4-pyridin-3-yloxyphenyl)benzamide
SMILESCOc1ccc(C(=O)Nc2ccc(Oc3cccnc3)cc2)cc1OC
InChIInChI=1S/C20H18N2O4/c1-24-18-10-5-14(12-19(18)25-2)20(23)22-15-6-8-16(9-7-15)26-17-4-3-11-21-13-17/h3-13H,1-2H3,(H,22,23)
InChIKeyCIHVIWFSMBRRSK-UHFFFAOYSA-N
XLogP4.14
TPSA69.68 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.37
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]pyridine-3-carboxamide
CID 22132777
4-methoxy-3-phenoxy-N-phenylbenzamide
CID 18626251
N-[3-[(4-phenoxyphenyl)carbamoyl]phenyl]pyridine-3-carboxamide
CID 55631172
3-fluoro-4-methoxy-N-pyridin-3-ylbenzamide
CID 25343484
N-(4-bromophenyl)-3,4-dimethoxybenzamide
CID 855033
(4-methoxyphenyl) N-(4-pyridin-3-yloxyphenyl)carbamate
CID 110188525
4-methoxy-1-N-(4-phenylphenyl)-3-N-pyridin-3-ylbenzene-1,3-dicarboxamide
CID 122500865
3,4-diethoxy-N-[4-methoxy-3-(pyridin-3-ylmethoxy)phenyl]benzamide
CID 46426672
N-[4-[(4-tert-butylbenzoyl)amino]phenyl]-3,4-dimethoxybenzamide
CID 15994045
3,4-dimethoxy-N-[4-(pyridin-4-ylmethylamino)phenyl]benzamide
CID 112983135
3-bromo-4-methoxy-N-[4-(3-methylphenoxy)phenyl]benzamide
CID 7603354
N-(4-methoxyphenyl)isoquinoline-6-carboxamide
CID 110485186

Frequently Asked Questions

What is the IUPAC name of 3,4-dimethoxy-N-(4-pyridin-3-yloxyphenyl)benzamide?
The IUPAC name of 3,4-dimethoxy-N-(4-pyridin-3-yloxyphenyl)benzamide (CID 90643074) is 3,4-dimethoxy-N-(4-pyridin-3-yloxyphenyl)benzamide.
What is the SMILES notation for 3,4-dimethoxy-N-(4-pyridin-3-yloxyphenyl)benzamide?
The canonical SMILES for 3,4-dimethoxy-N-(4-pyridin-3-yloxyphenyl)benzamide is COc1ccc(C(=O)Nc2ccc(Oc3cccnc3)cc2)cc1OC.
What is the InChIKey of 3,4-dimethoxy-N-(4-pyridin-3-yloxyphenyl)benzamide?
The InChIKey is CIHVIWFSMBRRSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2O4/c1-24-18-10-5-14(12-19(18)25-2)20(23)22-15-6-8-16(9-7-15)26-17-4-3-11-21-13-17/h3-13H,1-2H3,(H,22,23).
What are the key properties of 3,4-dimethoxy-N-(4-pyridin-3-yloxyphenyl)benzamide?
3,4-dimethoxy-N-(4-pyridin-3-yloxyphenyl)benzamide has a molecular weight of 350.37 g/mol, XLogP of 4.14, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dimethoxy-N-(4-pyridin-3-yloxyphenyl)benzamide is sourced from PubChem (CID 90643074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).