5-[(3-chlorophenoxy)methyl]-N-(1-methyl-6-oxo-3-pyridinyl)pyridine-2-carboxamide

C19H16ClN3O3 — CID 155153106

IUPAC5-[(3-chlorophenoxy)methyl]-N-(1-methyl-6-oxo-3-pyridinyl)pyridine-2-carboxamide
SMILESCn1cc(NC(=O)c2ccc(COc3cccc(Cl)c3)cn2)ccc1=O
InChIInChI=1S/C19H16ClN3O3/c1-23-11-15(6-8-18(23)24)22-19(25)17-7-5-13(10-21-17)12-26-16-4-2-3-14(20)9-16/h2-11H,12H2,1H3,(H,22,25)
InChIKeyRBXQIJDINHXJFU-UHFFFAOYSA-N
MW369.81 g/mol
LogP3.27
Rot. Bonds5

About 5-[(3-chlorophenoxy)methyl]-N-(1-methyl-6-oxo-3-pyridinyl)pyridine-2-carboxamide

5-[(3-chlorophenoxy)methyl]-N-(1-methyl-6-oxo-3-pyridinyl)pyridine-2-carboxamide (PubChem CID 155153106) has the molecular formula C19H16ClN3O3 and a molecular weight of 369.81 g/mol. Its IUPAC name is 5-[(3-chlorophenoxy)methyl]-N-(1-methyl-6-oxo-3-pyridinyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-[(3-chlorophenoxy)methyl]-N-(1-methyl-6-oxo-3-pyridinyl)pyridine-2-carboxamide
PubChem CID155153106
Molecular FormulaC19H16ClN3O3
Molecular Weight369.81 g/mol
Exact Mass369.09
IUPAC Name5-[(3-chlorophenoxy)methyl]-N-(1-methyl-6-oxo-3-pyridinyl)pyridine-2-carboxamide
SMILESCn1cc(NC(=O)c2ccc(COc3cccc(Cl)c3)cn2)ccc1=O
InChIInChI=1S/C19H16ClN3O3/c1-23-11-15(6-8-18(23)24)22-19(25)17-7-5-13(10-21-17)12-26-16-4-2-3-14(20)9-16/h2-11H,12H2,1H3,(H,22,25)
InChIKeyRBXQIJDINHXJFU-UHFFFAOYSA-N
XLogP3.27
TPSA73.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.81
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[5-[(3-chlorophenoxy)methyl]-2-pyridinyl]-1-methyl-6-oxopyridazine-3-carboxamide
CID 155153066
6-chloro-N-(1-methyl-6-oxo-3-pyridinyl)pyridine-2-carboxamide
CID 62234899
5-[(3-chlorophenoxy)methyl]-N-(3,4-dichlorophenyl)furan-2-carboxamide
CID 19446098
N-[4-[(4-bromopyrazol-1-yl)methyl]phenyl]-5-[(3-chlorophenoxy)methyl]furan-2-carboxamide
CID 996913
4-[(3-chlorophenoxy)methyl]-N-[(1-methylpyrazol-4-yl)methyl]benzamide
CID 19292411
N-[5-(3-chlorophenoxy)-2-pyridinyl]-1-methyl-6-oxopyridine-3-carboxamide
CID 139521731
6-chloro-N-(1-methyl-6-oxo-3-pyridinyl)pyrazine-2-carboxamide
CID 103187156
2,4-dichloro-N-(1-methyl-6-oxo-3-pyridinyl)benzamide
CID 110725053
4-[(4-chlorophenoxy)methyl]-N-[1-[(3-chlorophenoxy)methyl]pyrazol-4-yl]benzamide
CID 19408613
2,5-dichloro-N-(1-methyl-6-oxo-3-pyridinyl)pyridine-4-carboxamide
CID 114917371
N-[5-[(3,4-difluorophenoxy)methyl]-2-pyridinyl]-1-methyl-6-oxopyridazine-3-carboxamide
CID 139521986
2-chloro-N-(1-methyl-6-oxo-3-pyridinyl)pyridine-3-carboxamide
CID 61041355

Frequently Asked Questions

What is the IUPAC name of 5-[(3-chlorophenoxy)methyl]-N-(1-methyl-6-oxo-3-pyridinyl)pyridine-2-carboxamide?
The IUPAC name of 5-[(3-chlorophenoxy)methyl]-N-(1-methyl-6-oxo-3-pyridinyl)pyridine-2-carboxamide (CID 155153106) is 5-[(3-chlorophenoxy)methyl]-N-(1-methyl-6-oxo-3-pyridinyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-[(3-chlorophenoxy)methyl]-N-(1-methyl-6-oxo-3-pyridinyl)pyridine-2-carboxamide?
The canonical SMILES for 5-[(3-chlorophenoxy)methyl]-N-(1-methyl-6-oxo-3-pyridinyl)pyridine-2-carboxamide is Cn1cc(NC(=O)c2ccc(COc3cccc(Cl)c3)cn2)ccc1=O.
What is the InChIKey of 5-[(3-chlorophenoxy)methyl]-N-(1-methyl-6-oxo-3-pyridinyl)pyridine-2-carboxamide?
The InChIKey is RBXQIJDINHXJFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16ClN3O3/c1-23-11-15(6-8-18(23)24)22-19(25)17-7-5-13(10-21-17)12-26-16-4-2-3-14(20)9-16/h2-11H,12H2,1H3,(H,22,25).
What are the key properties of 5-[(3-chlorophenoxy)methyl]-N-(1-methyl-6-oxo-3-pyridinyl)pyridine-2-carboxamide?
5-[(3-chlorophenoxy)methyl]-N-(1-methyl-6-oxo-3-pyridinyl)pyridine-2-carboxamide has a molecular weight of 369.81 g/mol, XLogP of 3.27, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(3-chlorophenoxy)methyl]-N-(1-methyl-6-oxo-3-pyridinyl)pyridine-2-carboxamide is sourced from PubChem (CID 155153106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).