N-butyl-6-(2,5-dimethoxyanilino)-N-methylpyridine-3-carboxamide

C19H25N3O3 — CID 109161559

IUPACN-butyl-6-(2,5-dimethoxyanilino)-N-methylpyridine-3-carboxamide
SMILESCCCCN(C)C(=O)c1ccc(Nc2cc(OC)ccc2OC)nc1
InChIInChI=1S/C19H25N3O3/c1-5-6-11-22(2)19(23)14-7-10-18(20-13-14)21-16-12-15(24-3)8-9-17(16)25-4/h7-10,12-13H,5-6,11H2,1-4H3,(H,20,21)
InChIKeyOPSXKWSYZJDHKC-UHFFFAOYSA-N
MW343.43 g/mol
LogP3.71
Rot. Bonds8

About N-butyl-6-(2,5-dimethoxyanilino)-N-methylpyridine-3-carboxamide

N-butyl-6-(2,5-dimethoxyanilino)-N-methylpyridine-3-carboxamide (PubChem CID 109161559) has the molecular formula C19H25N3O3 and a molecular weight of 343.43 g/mol. Its IUPAC name is N-butyl-6-(2,5-dimethoxyanilino)-N-methylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-butyl-6-(2,5-dimethoxyanilino)-N-methylpyridine-3-carboxamide
PubChem CID109161559
Molecular FormulaC19H25N3O3
Molecular Weight343.43 g/mol
Exact Mass343.19
IUPAC NameN-butyl-6-(2,5-dimethoxyanilino)-N-methylpyridine-3-carboxamide
SMILESCCCCN(C)C(=O)c1ccc(Nc2cc(OC)ccc2OC)nc1
InChIInChI=1S/C19H25N3O3/c1-5-6-11-22(2)19(23)14-7-10-18(20-13-14)21-16-12-15(24-3)8-9-17(16)25-4/h7-10,12-13H,5-6,11H2,1-4H3,(H,20,21)
InChIKeyOPSXKWSYZJDHKC-UHFFFAOYSA-N
XLogP3.71
TPSA63.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.43
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-butyl-6-(2,5-dimethoxyanilino)-N-methylpyridazine-3-carboxamide
CID 109125715
methyl 2-[[5-[butyl(methyl)carbamoyl]-2-pyridinyl]amino]benzoate
CID 109161569
N-butyl-6-[2-(4-methoxyphenyl)ethylamino]-N-methylpyridine-3-carboxamide
CID 109158989
N-butyl-2-(2-methoxy-5-methylanilino)-N-methylpyrimidine-5-carboxamide
CID 109263915
6-(2-methoxy-5-methylanilino)-N-methyl-N-(2-pyridin-4-ylethyl)pyridine-3-carboxamide
CID 109159231
3-N-butyl-1-N-(2,5-dimethoxyphenyl)-3-N-methylbenzene-1,3-dicarboxamide
CID 109056400
N-butyl-6-[3-(dimethylamino)propylamino]-N-methylpyridine-3-carboxamide
CID 109154268
N-butyl-6-(2,3-dichloroanilino)-N-methylpyridine-3-carboxamide
CID 109161592
N-butyl-6-[2-(2-methoxyphenyl)ethylamino]-N-methylpyridine-3-carboxamide
CID 109158752
N'-butyl-N-(2,5-dimethoxyphenyl)-N'-methyloxamide
CID 108511949
N-[6-(2,5-dimethoxyanilino)-3-pyridinyl]-2-ethylbutanamide
CID 113019957
6-(2,5-dimethoxyanilino)-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide
CID 109157978

Frequently Asked Questions

What is the IUPAC name of N-butyl-6-(2,5-dimethoxyanilino)-N-methylpyridine-3-carboxamide?
The IUPAC name of N-butyl-6-(2,5-dimethoxyanilino)-N-methylpyridine-3-carboxamide (CID 109161559) is N-butyl-6-(2,5-dimethoxyanilino)-N-methylpyridine-3-carboxamide.
What is the SMILES notation for N-butyl-6-(2,5-dimethoxyanilino)-N-methylpyridine-3-carboxamide?
The canonical SMILES for N-butyl-6-(2,5-dimethoxyanilino)-N-methylpyridine-3-carboxamide is CCCCN(C)C(=O)c1ccc(Nc2cc(OC)ccc2OC)nc1.
What is the InChIKey of N-butyl-6-(2,5-dimethoxyanilino)-N-methylpyridine-3-carboxamide?
The InChIKey is OPSXKWSYZJDHKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O3/c1-5-6-11-22(2)19(23)14-7-10-18(20-13-14)21-16-12-15(24-3)8-9-17(16)25-4/h7-10,12-13H,5-6,11H2,1-4H3,(H,20,21).
What are the key properties of N-butyl-6-(2,5-dimethoxyanilino)-N-methylpyridine-3-carboxamide?
N-butyl-6-(2,5-dimethoxyanilino)-N-methylpyridine-3-carboxamide has a molecular weight of 343.43 g/mol, XLogP of 3.71, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-6-(2,5-dimethoxyanilino)-N-methylpyridine-3-carboxamide is sourced from PubChem (CID 109161559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).