5-chloro-N-(3-methoxyphenyl)-N-methyl-3-(methylamino)pyridine-2-carboxamide

C15H16ClN3O2 — CID 143610344

IUPAC5-chloro-N-(3-methoxyphenyl)-N-methyl-3-(methylamino)pyridine-2-carboxamide
SMILESCNc1cc(Cl)cnc1C(=O)N(C)c1cccc(OC)c1
InChIInChI=1S/C15H16ClN3O2/c1-17-13-7-10(16)9-18-14(13)15(20)19(2)11-5-4-6-12(8-11)21-3/h4-9,17H,1-3H3
InChIKeyYBTZWQLTEHKRKE-UHFFFAOYSA-N
MW305.77 g/mol
LogP3.06
Rot. Bonds4

About 5-chloro-N-(3-methoxyphenyl)-N-methyl-3-(methylamino)pyridine-2-carboxamide

5-chloro-N-(3-methoxyphenyl)-N-methyl-3-(methylamino)pyridine-2-carboxamide (PubChem CID 143610344) has the molecular formula C15H16ClN3O2 and a molecular weight of 305.77 g/mol. Its IUPAC name is 5-chloro-N-(3-methoxyphenyl)-N-methyl-3-(methylamino)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-chloro-N-(3-methoxyphenyl)-N-methyl-3-(methylamino)pyridine-2-carboxamide
PubChem CID143610344
Molecular FormulaC15H16ClN3O2
Molecular Weight305.77 g/mol
Exact Mass305.09
IUPAC Name5-chloro-N-(3-methoxyphenyl)-N-methyl-3-(methylamino)pyridine-2-carboxamide
SMILESCNc1cc(Cl)cnc1C(=O)N(C)c1cccc(OC)c1
InChIInChI=1S/C15H16ClN3O2/c1-17-13-7-10(16)9-18-14(13)15(20)19(2)11-5-4-6-12(8-11)21-3/h4-9,17H,1-3H3
InChIKeyYBTZWQLTEHKRKE-UHFFFAOYSA-N
XLogP3.06
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.77
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(3-methoxyphenyl)-N-methyl-3-(methylamino)pyridine-2-carboxamide?
The IUPAC name of 5-chloro-N-(3-methoxyphenyl)-N-methyl-3-(methylamino)pyridine-2-carboxamide (CID 143610344) is 5-chloro-N-(3-methoxyphenyl)-N-methyl-3-(methylamino)pyridine-2-carboxamide.
What is the SMILES notation for 5-chloro-N-(3-methoxyphenyl)-N-methyl-3-(methylamino)pyridine-2-carboxamide?
The canonical SMILES for 5-chloro-N-(3-methoxyphenyl)-N-methyl-3-(methylamino)pyridine-2-carboxamide is CNc1cc(Cl)cnc1C(=O)N(C)c1cccc(OC)c1.
What is the InChIKey of 5-chloro-N-(3-methoxyphenyl)-N-methyl-3-(methylamino)pyridine-2-carboxamide?
The InChIKey is YBTZWQLTEHKRKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16ClN3O2/c1-17-13-7-10(16)9-18-14(13)15(20)19(2)11-5-4-6-12(8-11)21-3/h4-9,17H,1-3H3.
What are the key properties of 5-chloro-N-(3-methoxyphenyl)-N-methyl-3-(methylamino)pyridine-2-carboxamide?
5-chloro-N-(3-methoxyphenyl)-N-methyl-3-(methylamino)pyridine-2-carboxamide has a molecular weight of 305.77 g/mol, XLogP of 3.06, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(3-methoxyphenyl)-N-methyl-3-(methylamino)pyridine-2-carboxamide is sourced from PubChem (CID 143610344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).