3,5-dimethoxy-N-[2-oxo-2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)ethyl]benzamide

C22H24N2O4 — CID 18106533

IUPAC3,5-dimethoxy-N-[2-oxo-2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)ethyl]benzamide
SMILESCOc1cc(OC)cc(C(=O)NCC(=O)N2CC=C(c3ccccc3)CC2)c1
InChIInChI=1S/C22H24N2O4/c1-27-19-12-18(13-20(14-19)28-2)22(26)23-15-21(25)24-10-8-17(9-11-24)16-6-4-3-5-7-16/h3-8,12-14H,9-11,15H2,1-2H3,(H,23,26)
InChIKeyVHIZZOXTDQYMON-UHFFFAOYSA-N
MW380.44 g/mol
LogP2.75
Rot. Bonds6

About 3,5-dimethoxy-N-[2-oxo-2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)ethyl]benzamide

3,5-dimethoxy-N-[2-oxo-2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)ethyl]benzamide (PubChem CID 18106533) has the molecular formula C22H24N2O4 and a molecular weight of 380.44 g/mol. Its IUPAC name is 3,5-dimethoxy-N-[2-oxo-2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)ethyl]benzamide.

Molecular Properties

Compound Name3,5-dimethoxy-N-[2-oxo-2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)ethyl]benzamide
PubChem CID18106533
Molecular FormulaC22H24N2O4
Molecular Weight380.44 g/mol
Exact Mass380.17
IUPAC Name3,5-dimethoxy-N-[2-oxo-2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)ethyl]benzamide
SMILESCOc1cc(OC)cc(C(=O)NCC(=O)N2CC=C(c3ccccc3)CC2)c1
InChIInChI=1S/C22H24N2O4/c1-27-19-12-18(13-20(14-19)28-2)22(26)23-15-21(25)24-10-8-17(9-11-24)16-6-4-3-5-7-16/h3-8,12-14H,9-11,15H2,1-2H3,(H,23,26)
InChIKeyVHIZZOXTDQYMON-UHFFFAOYSA-N
XLogP2.75
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.44
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Piperazine, 1,4-bis(3,4,5-trimethoxybenzoyl)-
CID 120984
N-(1-benzylpiperidin-4-yl)-3,5-dimethoxybenzamide
CID 14514271
2-[4-[[(3,5-Dimethoxy-4-methylbenzoyl)-(3-phenylpropyl)amino]methyl]phenyl]acetic acid
CID 66775043
4-(3,5-Dimethoxybenzoyl)-1,3-dihydroquinoxalin-2-one
CID 2420253
3-methoxy-N-(4-phenylbutan-2-yl)benzamide
CID 2914414
3,5-dimethoxy-N-(4-phenylbutan-2-yl)benzamide
CID 2915995
1-(3-Phenylprop-2-enyl)-4-(3,4,5-trimethoxybenzoyl)piperazine
CID 1048988
Tricetamide
CID 67763
N-Benzyl-3,4,5-trimethoxybenzamide
CID 736962
N1,N3-bis(3-methoxybenzyl)isophthalamide
CID 10111838
(3,3-Dimethyl-2-oxobutyl) 2-[(3,5-dimethoxybenzoyl)amino]acetate
CID 2441577
N-benzhydryl-3,5-dimethoxybenzamide
CID 873122

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethoxy-N-[2-oxo-2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)ethyl]benzamide?
The IUPAC name of 3,5-dimethoxy-N-[2-oxo-2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)ethyl]benzamide (CID 18106533) is 3,5-dimethoxy-N-[2-oxo-2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)ethyl]benzamide.
What is the SMILES notation for 3,5-dimethoxy-N-[2-oxo-2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)ethyl]benzamide?
The canonical SMILES for 3,5-dimethoxy-N-[2-oxo-2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)ethyl]benzamide is COc1cc(OC)cc(C(=O)NCC(=O)N2CC=C(c3ccccc3)CC2)c1.
What is the InChIKey of 3,5-dimethoxy-N-[2-oxo-2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)ethyl]benzamide?
The InChIKey is VHIZZOXTDQYMON-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O4/c1-27-19-12-18(13-20(14-19)28-2)22(26)23-15-21(25)24-10-8-17(9-11-24)16-6-4-3-5-7-16/h3-8,12-14H,9-11,15H2,1-2H3,(H,23,26).
What are the key properties of 3,5-dimethoxy-N-[2-oxo-2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)ethyl]benzamide?
3,5-dimethoxy-N-[2-oxo-2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)ethyl]benzamide has a molecular weight of 380.44 g/mol, XLogP of 2.75, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethoxy-N-[2-oxo-2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)ethyl]benzamide is sourced from PubChem (CID 18106533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).