2-(2-methoxy-5-methylanilino)-N-(pyridin-2-ylmethyl)acetamide

C16H19N3O2 — CID 108999277

IUPAC2-(2-methoxy-5-methylanilino)-N-(pyridin-2-ylmethyl)acetamide
SMILESCOc1ccc(C)cc1NCC(=O)NCc1ccccn1
InChIInChI=1S/C16H19N3O2/c1-12-6-7-15(21-2)14(9-12)18-11-16(20)19-10-13-5-3-4-8-17-13/h3-9,18H,10-11H2,1-2H3,(H,19,20)
InChIKeyKPPWGVJDWMWHRH-UHFFFAOYSA-N
MW285.35 g/mol
LogP2.13
Rot. Bonds6

About 2-(2-methoxy-5-methylanilino)-N-(pyridin-2-ylmethyl)acetamide

2-(2-methoxy-5-methylanilino)-N-(pyridin-2-ylmethyl)acetamide (PubChem CID 108999277) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is 2-(2-methoxy-5-methylanilino)-N-(pyridin-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(2-methoxy-5-methylanilino)-N-(pyridin-2-ylmethyl)acetamide
PubChem CID108999277
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC Name2-(2-methoxy-5-methylanilino)-N-(pyridin-2-ylmethyl)acetamide
SMILESCOc1ccc(C)cc1NCC(=O)NCc1ccccn1
InChIInChI=1S/C16H19N3O2/c1-12-6-7-15(21-2)14(9-12)18-11-16(20)19-10-13-5-3-4-8-17-13/h3-9,18H,10-11H2,1-2H3,(H,19,20)
InChIKeyKPPWGVJDWMWHRH-UHFFFAOYSA-N
XLogP2.13
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-(3,4-dimethoxyphenyl)sulfonyl-3,5-dimethylanilino]-N-(pyridin-2-ylmethyl)acetamide
CID 22304785
2-(2-propan-2-yloxyanilino)-N-(pyridin-2-ylmethyl)acetamide
CID 108999278
N-(2-methoxy-5-methylphenyl)-2-(pyridin-2-ylmethylamino)pyrimidine-4-carboxamide
CID 109306967
2-(2-ethylanilino)-N-(pyridin-2-ylmethyl)acetamide
CID 108999248
2-(2-tert-butylanilino)-N-(pyridin-2-ylmethyl)acetamide
CID 108999257
2-(2,4-dimethoxy-3-methylphenyl)-N-(pyridin-2-ylmethyl)acetamide
CID 110769817
4-methoxy-3-(pyridin-2-ylmethylamino)benzamide
CID 43735349
4-methoxy-3-(pyridin-2-ylmethylamino)benzoate
CID 7201409
5-tert-butyl-2-methoxy-N-(pyridin-2-ylmethyl)benzamide
CID 110761323
3-(2,5-dimethylphenoxy)-N-(pyridin-2-ylmethyl)propanamide
CID 8880667
2-(2,5-dimethylanilino)-N-(2-methoxyphenyl)acetamide
CID 9079653
2-(2,4-dichloroanilino)-N-(pyridin-2-ylmethyl)acetamide
CID 108999324

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxy-5-methylanilino)-N-(pyridin-2-ylmethyl)acetamide?
The IUPAC name of 2-(2-methoxy-5-methylanilino)-N-(pyridin-2-ylmethyl)acetamide (CID 108999277) is 2-(2-methoxy-5-methylanilino)-N-(pyridin-2-ylmethyl)acetamide.
What is the SMILES notation for 2-(2-methoxy-5-methylanilino)-N-(pyridin-2-ylmethyl)acetamide?
The canonical SMILES for 2-(2-methoxy-5-methylanilino)-N-(pyridin-2-ylmethyl)acetamide is COc1ccc(C)cc1NCC(=O)NCc1ccccn1.
What is the InChIKey of 2-(2-methoxy-5-methylanilino)-N-(pyridin-2-ylmethyl)acetamide?
The InChIKey is KPPWGVJDWMWHRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-12-6-7-15(21-2)14(9-12)18-11-16(20)19-10-13-5-3-4-8-17-13/h3-9,18H,10-11H2,1-2H3,(H,19,20).
What are the key properties of 2-(2-methoxy-5-methylanilino)-N-(pyridin-2-ylmethyl)acetamide?
2-(2-methoxy-5-methylanilino)-N-(pyridin-2-ylmethyl)acetamide has a molecular weight of 285.35 g/mol, XLogP of 2.13, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxy-5-methylanilino)-N-(pyridin-2-ylmethyl)acetamide is sourced from PubChem (CID 108999277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).