N-(2-methoxyphenyl)-4-(N-methylanilino)pyridine-2-carboxamide

C20H19N3O2 — CID 109219451

IUPACN-(2-methoxyphenyl)-4-(N-methylanilino)pyridine-2-carboxamide
SMILESCOc1ccccc1NC(=O)c1cc(N(C)c2ccccc2)ccn1
InChIInChI=1S/C20H19N3O2/c1-23(15-8-4-3-5-9-15)16-12-13-21-18(14-16)20(24)22-17-10-6-7-11-19(17)25-2/h3-14H,1-2H3,(H,22,24)
InChIKeyKMRVCZOHMPYZEG-UHFFFAOYSA-N
MW333.39 g/mol
LogP4.11
Rot. Bonds5

About N-(2-methoxyphenyl)-4-(N-methylanilino)pyridine-2-carboxamide

N-(2-methoxyphenyl)-4-(N-methylanilino)pyridine-2-carboxamide (PubChem CID 109219451) has the molecular formula C20H19N3O2 and a molecular weight of 333.39 g/mol. Its IUPAC name is N-(2-methoxyphenyl)-4-(N-methylanilino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2-methoxyphenyl)-4-(N-methylanilino)pyridine-2-carboxamide
PubChem CID109219451
Molecular FormulaC20H19N3O2
Molecular Weight333.39 g/mol
Exact Mass333.15
IUPAC NameN-(2-methoxyphenyl)-4-(N-methylanilino)pyridine-2-carboxamide
SMILESCOc1ccccc1NC(=O)c1cc(N(C)c2ccccc2)ccn1
InChIInChI=1S/C20H19N3O2/c1-23(15-8-4-3-5-9-15)16-12-13-21-18(14-16)20(24)22-17-10-6-7-11-19(17)25-2/h3-14H,1-2H3,(H,22,24)
InChIKeyKMRVCZOHMPYZEG-UHFFFAOYSA-N
XLogP4.11
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.39
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyphenyl)-4-(N-methylanilino)pyridine-2-carboxamide?
The IUPAC name of N-(2-methoxyphenyl)-4-(N-methylanilino)pyridine-2-carboxamide (CID 109219451) is N-(2-methoxyphenyl)-4-(N-methylanilino)pyridine-2-carboxamide.
What is the SMILES notation for N-(2-methoxyphenyl)-4-(N-methylanilino)pyridine-2-carboxamide?
The canonical SMILES for N-(2-methoxyphenyl)-4-(N-methylanilino)pyridine-2-carboxamide is COc1ccccc1NC(=O)c1cc(N(C)c2ccccc2)ccn1.
What is the InChIKey of N-(2-methoxyphenyl)-4-(N-methylanilino)pyridine-2-carboxamide?
The InChIKey is KMRVCZOHMPYZEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O2/c1-23(15-8-4-3-5-9-15)16-12-13-21-18(14-16)20(24)22-17-10-6-7-11-19(17)25-2/h3-14H,1-2H3,(H,22,24).
What are the key properties of N-(2-methoxyphenyl)-4-(N-methylanilino)pyridine-2-carboxamide?
N-(2-methoxyphenyl)-4-(N-methylanilino)pyridine-2-carboxamide has a molecular weight of 333.39 g/mol, XLogP of 4.11, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyphenyl)-4-(N-methylanilino)pyridine-2-carboxamide is sourced from PubChem (CID 109219451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).