N,3,5-trimethyl-4-(pyridin-3-ylmethoxy)benzamide

C16H18N2O2 — CID 166187994

IUPACN,3,5-trimethyl-4-(pyridin-3-ylmethoxy)benzamide
SMILESCNC(=O)c1cc(C)c(OCc2cccnc2)c(C)c1
InChIInChI=1S/C16H18N2O2/c1-11-7-14(16(19)17-3)8-12(2)15(11)20-10-13-5-4-6-18-9-13/h4-9H,10H2,1-3H3,(H,17,19)
InChIKeyNSOJDEOMJDVWTE-UHFFFAOYSA-N
MW270.33 g/mol
LogP2.64
Rot. Bonds4

About N,3,5-trimethyl-4-(pyridin-3-ylmethoxy)benzamide

N,3,5-trimethyl-4-(pyridin-3-ylmethoxy)benzamide (PubChem CID 166187994) has the molecular formula C16H18N2O2 and a molecular weight of 270.33 g/mol. Its IUPAC name is N,3,5-trimethyl-4-(pyridin-3-ylmethoxy)benzamide.

Molecular Properties

Compound NameN,3,5-trimethyl-4-(pyridin-3-ylmethoxy)benzamide
PubChem CID166187994
Molecular FormulaC16H18N2O2
Molecular Weight270.33 g/mol
Exact Mass270.14
IUPAC NameN,3,5-trimethyl-4-(pyridin-3-ylmethoxy)benzamide
SMILESCNC(=O)c1cc(C)c(OCc2cccnc2)c(C)c1
InChIInChI=1S/C16H18N2O2/c1-11-7-14(16(19)17-3)8-12(2)15(11)20-10-13-5-4-6-18-9-13/h4-9H,10H2,1-3H3,(H,17,19)
InChIKeyNSOJDEOMJDVWTE-UHFFFAOYSA-N
XLogP2.64
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N'-[3,5-dimethyl-4-(pyridin-3-ylmethoxy)benzoyl]pyridine-3-carbohydrazide
CID 39716937
3,5-dimethyl-N-[2-(methylamino)ethyl]-4-(pyridin-3-ylmethoxy)benzamide
CID 119503562
N'-(2-chlorobenzoyl)-3,5-dimethyl-4-(pyridin-3-ylmethoxy)benzohydrazide
CID 55691668
N-(3-hydroxy-4-pyridinyl)-3,5-dimethyl-4-(pyridin-3-ylmethoxy)benzamide
CID 75370477
N-cyclopropyl-3,5-dimethyl-N-[[4-(methylcarbamoyl)phenyl]methyl]-4-(pyridin-3-ylmethoxy)benzamide
CID 39881162
2-[[3,5-dimethyl-4-(pyridin-3-ylmethoxy)benzoyl]amino]-2-methylbutanoic acid
CID 120518519
3,5-dimethyl-N-[2-(pyrazin-2-ylamino)ethyl]-4-(pyridin-3-ylmethoxy)benzamide
CID 47031577
N-(1-amino-2,3-dimethylbutan-2-yl)-3,5-dimethyl-4-(pyridin-3-ylmethoxy)benzamide
CID 119608365
2-[[[3,5-dimethyl-4-(pyridin-3-ylmethoxy)benzoyl]amino]methyl]-4-methylpentanoic acid
CID 120528545
N-(2,4-dimethoxyphenyl)-3,5-dimethyl-4-(pyridin-3-ylmethoxy)benzamide
CID 39709892
N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-3,5-dimethyl-4-(pyridin-3-ylmethoxy)benzamide
CID 55690776
3-cyclopropyl-2-[[3,5-dimethyl-4-(pyridin-3-ylmethoxy)benzoyl]amino]propanoic acid
CID 120535842

Frequently Asked Questions

What is the IUPAC name of N,3,5-trimethyl-4-(pyridin-3-ylmethoxy)benzamide?
The IUPAC name of N,3,5-trimethyl-4-(pyridin-3-ylmethoxy)benzamide (CID 166187994) is N,3,5-trimethyl-4-(pyridin-3-ylmethoxy)benzamide.
What is the SMILES notation for N,3,5-trimethyl-4-(pyridin-3-ylmethoxy)benzamide?
The canonical SMILES for N,3,5-trimethyl-4-(pyridin-3-ylmethoxy)benzamide is CNC(=O)c1cc(C)c(OCc2cccnc2)c(C)c1.
What is the InChIKey of N,3,5-trimethyl-4-(pyridin-3-ylmethoxy)benzamide?
The InChIKey is NSOJDEOMJDVWTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2/c1-11-7-14(16(19)17-3)8-12(2)15(11)20-10-13-5-4-6-18-9-13/h4-9H,10H2,1-3H3,(H,17,19).
What are the key properties of N,3,5-trimethyl-4-(pyridin-3-ylmethoxy)benzamide?
N,3,5-trimethyl-4-(pyridin-3-ylmethoxy)benzamide has a molecular weight of 270.33 g/mol, XLogP of 2.64, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,3,5-trimethyl-4-(pyridin-3-ylmethoxy)benzamide is sourced from PubChem (CID 166187994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).