3-methoxy-N-[(3-methoxyphenyl)methyl]-4-(3-methylpyrazolidin-4-yl)benzamide

C20H25N3O3 — CID 131635937

IUPAC3-methoxy-N-[(3-methoxyphenyl)methyl]-4-(3-methylpyrazolidin-4-yl)benzamide
SMILESCOc1cccc(CNC(=O)c2ccc(C3CNNC3C)c(OC)c2)c1
InChIInChI=1S/C20H25N3O3/c1-13-18(12-22-23-13)17-8-7-15(10-19(17)26-3)20(24)21-11-14-5-4-6-16(9-14)25-2/h4-10,13,18,22-23H,11-12H2,1-3H3,(H,21,24)
InChIKeyZEYGFSRDZGFBNF-UHFFFAOYSA-N
MW355.44 g/mol
LogP2.21
Rot. Bonds6

About 3-methoxy-N-[(3-methoxyphenyl)methyl]-4-(3-methylpyrazolidin-4-yl)benzamide

3-methoxy-N-[(3-methoxyphenyl)methyl]-4-(3-methylpyrazolidin-4-yl)benzamide (PubChem CID 131635937) has the molecular formula C20H25N3O3 and a molecular weight of 355.44 g/mol. Its IUPAC name is 3-methoxy-N-[(3-methoxyphenyl)methyl]-4-(3-methylpyrazolidin-4-yl)benzamide.

Molecular Properties

Compound Name3-methoxy-N-[(3-methoxyphenyl)methyl]-4-(3-methylpyrazolidin-4-yl)benzamide
PubChem CID131635937
Molecular FormulaC20H25N3O3
Molecular Weight355.44 g/mol
Exact Mass355.19
IUPAC Name3-methoxy-N-[(3-methoxyphenyl)methyl]-4-(3-methylpyrazolidin-4-yl)benzamide
SMILESCOc1cccc(CNC(=O)c2ccc(C3CNNC3C)c(OC)c2)c1
InChIInChI=1S/C20H25N3O3/c1-13-18(12-22-23-13)17-8-7-15(10-19(17)26-3)20(24)21-11-14-5-4-6-16(9-14)25-2/h4-10,13,18,22-23H,11-12H2,1-3H3,(H,21,24)
InChIKeyZEYGFSRDZGFBNF-UHFFFAOYSA-N
XLogP2.21
TPSA71.62 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.44
LogP ≤ 52.21
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

3-ethoxy-4-methoxy-N-[(3-methoxyphenyl)methyl]benzamide
CID 38652199
N-[(3-fluorophenyl)methyl]-3-methoxy-4-pyrazolidin-4-ylbenzamide
CID 131635886
3-methoxy-N-[[3-[(1-methylcyclopropyl)carbamoyl]phenyl]methyl]-4-pyrazolidin-4-ylbenzamide
CID 131635934
4-[(3-methoxyphenyl)methylcarbamoyl]pyridine-2-carboxylic acid
CID 115730110
4-[(3-methoxyphenyl)methylcarbamoyl]benzoic acid
CID 61028664
N-[[3-[[(3,4-dimethoxybenzoyl)amino]methyl]phenyl]methyl]-3,4-dimethoxybenzamide
CID 2841934
2-hydrazinyl-N-[(3-methoxyphenyl)methyl]pyridine-4-carboxamide
CID 62237337
3,4-difluoro-N-[(3-methoxyphenyl)methyl]benzamide
CID 30491738
3-N-[(3-methoxyphenyl)methyl]-1-N-[(4-methoxyphenyl)methyl]benzene-1,3-dicarboxamide
CID 10272573
4-methoxy-N-[(3-methoxyphenyl)methyl]-3-nitrobenzamide
CID 7749788
N-[(3-methoxyphenyl)methyl]-2-oxo-1H-pyridine-4-carboxamide
CID 103762651
3-methoxy-N-[(3-methoxyphenyl)methyl]-4-(5-methyl-1H-pyrazol-4-yl)benzamide
CID 90353897

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-[(3-methoxyphenyl)methyl]-4-(3-methylpyrazolidin-4-yl)benzamide?
The IUPAC name of 3-methoxy-N-[(3-methoxyphenyl)methyl]-4-(3-methylpyrazolidin-4-yl)benzamide (CID 131635937) is 3-methoxy-N-[(3-methoxyphenyl)methyl]-4-(3-methylpyrazolidin-4-yl)benzamide.
What is the SMILES notation for 3-methoxy-N-[(3-methoxyphenyl)methyl]-4-(3-methylpyrazolidin-4-yl)benzamide?
The canonical SMILES for 3-methoxy-N-[(3-methoxyphenyl)methyl]-4-(3-methylpyrazolidin-4-yl)benzamide is COc1cccc(CNC(=O)c2ccc(C3CNNC3C)c(OC)c2)c1.
What is the InChIKey of 3-methoxy-N-[(3-methoxyphenyl)methyl]-4-(3-methylpyrazolidin-4-yl)benzamide?
The InChIKey is ZEYGFSRDZGFBNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O3/c1-13-18(12-22-23-13)17-8-7-15(10-19(17)26-3)20(24)21-11-14-5-4-6-16(9-14)25-2/h4-10,13,18,22-23H,11-12H2,1-3H3,(H,21,24).
What are the key properties of 3-methoxy-N-[(3-methoxyphenyl)methyl]-4-(3-methylpyrazolidin-4-yl)benzamide?
3-methoxy-N-[(3-methoxyphenyl)methyl]-4-(3-methylpyrazolidin-4-yl)benzamide has a molecular weight of 355.44 g/mol, XLogP of 2.21, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-[(3-methoxyphenyl)methyl]-4-(3-methylpyrazolidin-4-yl)benzamide is sourced from PubChem (CID 131635937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).