1-[(4-chlorophenyl)methyl]-N-(2-morpholin-4-ylethyl)-6-oxopyridine-3-carboxamide

C19H22ClN3O3 — CID 3364826

IUPAC1-[(4-chlorophenyl)methyl]-N-(2-morpholin-4-ylethyl)-6-oxopyridine-3-carboxamide
SMILESO=C(NCCN1CCOCC1)c1ccc(=O)n(Cc2ccc(Cl)cc2)c1
InChIInChI=1S/C19H22ClN3O3/c20-17-4-1-15(2-5-17)13-23-14-16(3-6-18(23)24)19(25)21-7-8-22-9-11-26-12-10-22/h1-6,14H,7-13H2,(H,21,25)
InChIKeyDGRGOSGQOQWJCO-UHFFFAOYSA-N
MW375.86 g/mol
LogP1.61
Rot. Bonds6

About 1-[(4-chlorophenyl)methyl]-N-(2-morpholin-4-ylethyl)-6-oxopyridine-3-carboxamide

1-[(4-chlorophenyl)methyl]-N-(2-morpholin-4-ylethyl)-6-oxopyridine-3-carboxamide (PubChem CID 3364826) has the molecular formula C19H22ClN3O3 and a molecular weight of 375.86 g/mol. Its IUPAC name is 1-[(4-chlorophenyl)methyl]-N-(2-morpholin-4-ylethyl)-6-oxopyridine-3-carboxamide.

Molecular Properties

Compound Name1-[(4-chlorophenyl)methyl]-N-(2-morpholin-4-ylethyl)-6-oxopyridine-3-carboxamide
PubChem CID3364826
Molecular FormulaC19H22ClN3O3
Molecular Weight375.86 g/mol
Exact Mass375.13
IUPAC Name1-[(4-chlorophenyl)methyl]-N-(2-morpholin-4-ylethyl)-6-oxopyridine-3-carboxamide
SMILESO=C(NCCN1CCOCC1)c1ccc(=O)n(Cc2ccc(Cl)cc2)c1
InChIInChI=1S/C19H22ClN3O3/c20-17-4-1-15(2-5-17)13-23-14-16(3-6-18(23)24)19(25)21-7-8-22-9-11-26-12-10-22/h1-6,14H,7-13H2,(H,21,25)
InChIKeyDGRGOSGQOQWJCO-UHFFFAOYSA-N
XLogP1.61
TPSA63.57 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.86
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-[(4-chlorophenyl)methyl]-N-(2-morpholin-4-ylethyl)-6-oxopyridine-3-carboxamide?
The IUPAC name of 1-[(4-chlorophenyl)methyl]-N-(2-morpholin-4-ylethyl)-6-oxopyridine-3-carboxamide (CID 3364826) is 1-[(4-chlorophenyl)methyl]-N-(2-morpholin-4-ylethyl)-6-oxopyridine-3-carboxamide.
What is the SMILES notation for 1-[(4-chlorophenyl)methyl]-N-(2-morpholin-4-ylethyl)-6-oxopyridine-3-carboxamide?
The canonical SMILES for 1-[(4-chlorophenyl)methyl]-N-(2-morpholin-4-ylethyl)-6-oxopyridine-3-carboxamide is O=C(NCCN1CCOCC1)c1ccc(=O)n(Cc2ccc(Cl)cc2)c1.
What is the InChIKey of 1-[(4-chlorophenyl)methyl]-N-(2-morpholin-4-ylethyl)-6-oxopyridine-3-carboxamide?
The InChIKey is DGRGOSGQOQWJCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22ClN3O3/c20-17-4-1-15(2-5-17)13-23-14-16(3-6-18(23)24)19(25)21-7-8-22-9-11-26-12-10-22/h1-6,14H,7-13H2,(H,21,25).
What are the key properties of 1-[(4-chlorophenyl)methyl]-N-(2-morpholin-4-ylethyl)-6-oxopyridine-3-carboxamide?
1-[(4-chlorophenyl)methyl]-N-(2-morpholin-4-ylethyl)-6-oxopyridine-3-carboxamide has a molecular weight of 375.86 g/mol, XLogP of 1.61, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-chlorophenyl)methyl]-N-(2-morpholin-4-ylethyl)-6-oxopyridine-3-carboxamide is sourced from PubChem (CID 3364826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).