4-[[5-[(dimethylamino)methyl]-2-pyridinyl]methoxy]benzamide

C16H19N3O2 — CID 141120481

IUPAC4-[[5-[(dimethylamino)methyl]-2-pyridinyl]methoxy]benzamide
SMILESCN(C)Cc1ccc(COc2ccc(C(N)=O)cc2)nc1
InChIInChI=1S/C16H19N3O2/c1-19(2)10-12-3-6-14(18-9-12)11-21-15-7-4-13(5-8-15)16(17)20/h3-9H,10-11H2,1-2H3,(H2,17,20)
InChIKeyCSKSBECVPMTVFK-UHFFFAOYSA-N
MW285.35 g/mol
LogP1.82
Rot. Bonds6

About 4-[[5-[(dimethylamino)methyl]-2-pyridinyl]methoxy]benzamide

4-[[5-[(dimethylamino)methyl]-2-pyridinyl]methoxy]benzamide (PubChem CID 141120481) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is 4-[[5-[(dimethylamino)methyl]-2-pyridinyl]methoxy]benzamide.

Molecular Properties

Compound Name4-[[5-[(dimethylamino)methyl]-2-pyridinyl]methoxy]benzamide
PubChem CID141120481
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC Name4-[[5-[(dimethylamino)methyl]-2-pyridinyl]methoxy]benzamide
SMILESCN(C)Cc1ccc(COc2ccc(C(N)=O)cc2)nc1
InChIInChI=1S/C16H19N3O2/c1-19(2)10-12-3-6-14(18-9-12)11-21-15-7-4-13(5-8-15)16(17)20/h3-9H,10-11H2,1-2H3,(H2,17,20)
InChIKeyCSKSBECVPMTVFK-UHFFFAOYSA-N
XLogP1.82
TPSA68.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(6-hydrazinyl-3-pyridinyl)methoxy]benzamide
CID 62244712
6-[[4-(2-oxopropyl)phenoxy]methyl]pyridine-3-carboxylic acid
CID 115493828
6-(methoxymethyl)pyridine-3-carboxamide
CID 23130505
4-[(4-cyanophenoxy)methyl]benzamide
CID 11831905
4-[(4-propoxyphenoxy)methyl]benzamide
CID 24605968
4-[[4-(methylamino)phenoxy]methyl]benzamide
CID 54908957
4-[(3-amino-4-methoxyphenyl)methoxy]benzamide
CID 28557381
4-[(4-chloro-2-pyridinyl)methoxy]benzamide
CID 79255855
4-[(3-fluoro-4-methoxyphenyl)methoxy]benzamide
CID 7893423
4-[(5-chloro-2-pyridinyl)methoxy]-N-(2-hydroxyethyl)-N-methylbenzamide
CID 86795441
2-[2-[4-[(dimethylamino)methyl]-2-methylphenyl]-2-oxoethyl]-5-[(5-methoxy-2-pyridinyl)methoxy]pyridazin-3-one
CID 71714121
1-[4-[(5-bromo-2-pyridinyl)methoxy]phenyl]propan-2-one
CID 104797397

Frequently Asked Questions

What is the IUPAC name of 4-[[5-[(dimethylamino)methyl]-2-pyridinyl]methoxy]benzamide?
The IUPAC name of 4-[[5-[(dimethylamino)methyl]-2-pyridinyl]methoxy]benzamide (CID 141120481) is 4-[[5-[(dimethylamino)methyl]-2-pyridinyl]methoxy]benzamide.
What is the SMILES notation for 4-[[5-[(dimethylamino)methyl]-2-pyridinyl]methoxy]benzamide?
The canonical SMILES for 4-[[5-[(dimethylamino)methyl]-2-pyridinyl]methoxy]benzamide is CN(C)Cc1ccc(COc2ccc(C(N)=O)cc2)nc1.
What is the InChIKey of 4-[[5-[(dimethylamino)methyl]-2-pyridinyl]methoxy]benzamide?
The InChIKey is CSKSBECVPMTVFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-19(2)10-12-3-6-14(18-9-12)11-21-15-7-4-13(5-8-15)16(17)20/h3-9H,10-11H2,1-2H3,(H2,17,20).
What are the key properties of 4-[[5-[(dimethylamino)methyl]-2-pyridinyl]methoxy]benzamide?
4-[[5-[(dimethylamino)methyl]-2-pyridinyl]methoxy]benzamide has a molecular weight of 285.35 g/mol, XLogP of 1.82, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[5-[(dimethylamino)methyl]-2-pyridinyl]methoxy]benzamide is sourced from PubChem (CID 141120481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).