2-[butyl(methyl)amino]-N-(4-chloro-2-methoxy-5-methylphenyl)pyridine-4-carboxamide

C19H24ClN3O2 — CID 109175621

IUPAC2-[butyl(methyl)amino]-N-(4-chloro-2-methoxy-5-methylphenyl)pyridine-4-carboxamide
SMILESCCCCN(C)c1cc(C(=O)Nc2cc(C)c(Cl)cc2OC)ccn1
InChIInChI=1S/C19H24ClN3O2/c1-5-6-9-23(3)18-11-14(7-8-21-18)19(24)22-16-10-13(2)15(20)12-17(16)25-4/h7-8,10-12H,5-6,9H2,1-4H3,(H,22,24)
InChIKeyHFUQTJLZEKDAMF-UHFFFAOYSA-N
MW361.87 g/mol
LogP4.54
Rot. Bonds7

About 2-[butyl(methyl)amino]-N-(4-chloro-2-methoxy-5-methylphenyl)pyridine-4-carboxamide

2-[butyl(methyl)amino]-N-(4-chloro-2-methoxy-5-methylphenyl)pyridine-4-carboxamide (PubChem CID 109175621) has the molecular formula C19H24ClN3O2 and a molecular weight of 361.87 g/mol. Its IUPAC name is 2-[butyl(methyl)amino]-N-(4-chloro-2-methoxy-5-methylphenyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-[butyl(methyl)amino]-N-(4-chloro-2-methoxy-5-methylphenyl)pyridine-4-carboxamide
PubChem CID109175621
Molecular FormulaC19H24ClN3O2
Molecular Weight361.87 g/mol
Exact Mass361.16
IUPAC Name2-[butyl(methyl)amino]-N-(4-chloro-2-methoxy-5-methylphenyl)pyridine-4-carboxamide
SMILESCCCCN(C)c1cc(C(=O)Nc2cc(C)c(Cl)cc2OC)ccn1
InChIInChI=1S/C19H24ClN3O2/c1-5-6-9-23(3)18-11-14(7-8-21-18)19(24)22-16-10-13(2)15(20)12-17(16)25-4/h7-8,10-12H,5-6,9H2,1-4H3,(H,22,24)
InChIKeyHFUQTJLZEKDAMF-UHFFFAOYSA-N
XLogP4.54
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.87
LogP ≤ 54.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[butyl(methyl)amino]-N-(4-chloro-2-methoxy-5-methylphenyl)pyrimidine-5-carboxamide
CID 109264082
N-(4-chloro-2-methoxy-5-methylphenyl)-3-methoxy-4-methylbenzamide
CID 9083792
N-(5-chloro-2-methoxyphenyl)-2-(dipropylamino)pyridine-4-carboxamide
CID 109175912
6-(butylamino)-N-(4-chloro-2-methoxy-5-methylphenyl)pyridine-3-carboxamide
CID 109151665
methyl 3-[[2-[butyl(methyl)amino]pyridine-4-carbonyl]amino]benzoate
CID 109175597
4-N-tert-butyl-2-N-(4-chloro-2-methoxy-5-methylphenyl)pyridine-2,4-dicarboxamide
CID 109089227
4-N-(4-chloro-2-methoxy-5-methylphenyl)-1-N-[2-(dimethylamino)ethyl]benzene-1,4-dicarboxamide
CID 109045847
N-(4-chloro-2-methoxy-5-methylphenyl)-2-(2-fluoroanilino)pyridine-4-carboxamide
CID 109177274
2-[acetyl(butyl)amino]-N-(4-chloro-2-methoxy-5-methylphenyl)acetamide
CID 113158798
N-(4-chloro-2-methoxy-5-methylphenyl)-4-iodobenzamide
CID 1297130
N-(4-chloro-2-methoxy-5-methylphenyl)-6-(N-methylanilino)pyridine-3-carboxamide
CID 109162350
N-(4-chloro-2-methoxy-5-methylphenyl)-2-(pyridin-3-ylmethylamino)pyridine-4-carboxamide
CID 109171981

Frequently Asked Questions

What is the IUPAC name of 2-[butyl(methyl)amino]-N-(4-chloro-2-methoxy-5-methylphenyl)pyridine-4-carboxamide?
The IUPAC name of 2-[butyl(methyl)amino]-N-(4-chloro-2-methoxy-5-methylphenyl)pyridine-4-carboxamide (CID 109175621) is 2-[butyl(methyl)amino]-N-(4-chloro-2-methoxy-5-methylphenyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-[butyl(methyl)amino]-N-(4-chloro-2-methoxy-5-methylphenyl)pyridine-4-carboxamide?
The canonical SMILES for 2-[butyl(methyl)amino]-N-(4-chloro-2-methoxy-5-methylphenyl)pyridine-4-carboxamide is CCCCN(C)c1cc(C(=O)Nc2cc(C)c(Cl)cc2OC)ccn1.
What is the InChIKey of 2-[butyl(methyl)amino]-N-(4-chloro-2-methoxy-5-methylphenyl)pyridine-4-carboxamide?
The InChIKey is HFUQTJLZEKDAMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24ClN3O2/c1-5-6-9-23(3)18-11-14(7-8-21-18)19(24)22-16-10-13(2)15(20)12-17(16)25-4/h7-8,10-12H,5-6,9H2,1-4H3,(H,22,24).
What are the key properties of 2-[butyl(methyl)amino]-N-(4-chloro-2-methoxy-5-methylphenyl)pyridine-4-carboxamide?
2-[butyl(methyl)amino]-N-(4-chloro-2-methoxy-5-methylphenyl)pyridine-4-carboxamide has a molecular weight of 361.87 g/mol, XLogP of 4.54, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[butyl(methyl)amino]-N-(4-chloro-2-methoxy-5-methylphenyl)pyridine-4-carboxamide is sourced from PubChem (CID 109175621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).