2-ethyl-6-oxo-N-(pyridin-4-ylmethyl)-1H-pyridine-4-carboxamide

C14H15N3O2 — CID 74237283

IUPAC2-ethyl-6-oxo-N-(pyridin-4-ylmethyl)-1H-pyridine-4-carboxamide
SMILESCCc1cc(C(=O)NCc2ccncc2)cc(=O)[nH]1
InChIInChI=1S/C14H15N3O2/c1-2-12-7-11(8-13(18)17-12)14(19)16-9-10-3-5-15-6-4-10/h3-8H,2,9H2,1H3,(H,16,19)(H,17,18)
InChIKeyPCOZVMXQBARRQR-UHFFFAOYSA-N
MW257.29 g/mol
LogP1.26
Rot. Bonds4

About 2-ethyl-6-oxo-N-(pyridin-4-ylmethyl)-1H-pyridine-4-carboxamide

2-ethyl-6-oxo-N-(pyridin-4-ylmethyl)-1H-pyridine-4-carboxamide (PubChem CID 74237283) has the molecular formula C14H15N3O2 and a molecular weight of 257.29 g/mol. Its IUPAC name is 2-ethyl-6-oxo-N-(pyridin-4-ylmethyl)-1H-pyridine-4-carboxamide.

Molecular Properties

Compound Name2-ethyl-6-oxo-N-(pyridin-4-ylmethyl)-1H-pyridine-4-carboxamide
PubChem CID74237283
Molecular FormulaC14H15N3O2
Molecular Weight257.29 g/mol
Exact Mass257.12
IUPAC Name2-ethyl-6-oxo-N-(pyridin-4-ylmethyl)-1H-pyridine-4-carboxamide
SMILESCCc1cc(C(=O)NCc2ccncc2)cc(=O)[nH]1
InChIInChI=1S/C14H15N3O2/c1-2-12-7-11(8-13(18)17-12)14(19)16-9-10-3-5-15-6-4-10/h3-8H,2,9H2,1H3,(H,16,19)(H,17,18)
InChIKeyPCOZVMXQBARRQR-UHFFFAOYSA-N
XLogP1.26
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 51.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

CID 4197
CID 4197
CID 3698
CID 3698
CID 3748
CID 3748
CID 64950
CID 64950
CID 15074
CID 15074
CID 71602
CID 71602
CID 10089466
CID 10089466
CID 55263
CID 55263
CID 40146
CID 40146
CID 3035194
CID 3035194
CID 78007
CID 78007
CID 78893
CID 78893

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-6-oxo-N-(pyridin-4-ylmethyl)-1H-pyridine-4-carboxamide?
The IUPAC name of 2-ethyl-6-oxo-N-(pyridin-4-ylmethyl)-1H-pyridine-4-carboxamide (CID 74237283) is 2-ethyl-6-oxo-N-(pyridin-4-ylmethyl)-1H-pyridine-4-carboxamide.
What is the SMILES notation for 2-ethyl-6-oxo-N-(pyridin-4-ylmethyl)-1H-pyridine-4-carboxamide?
The canonical SMILES for 2-ethyl-6-oxo-N-(pyridin-4-ylmethyl)-1H-pyridine-4-carboxamide is CCc1cc(C(=O)NCc2ccncc2)cc(=O)[nH]1.
What is the InChIKey of 2-ethyl-6-oxo-N-(pyridin-4-ylmethyl)-1H-pyridine-4-carboxamide?
The InChIKey is PCOZVMXQBARRQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O2/c1-2-12-7-11(8-13(18)17-12)14(19)16-9-10-3-5-15-6-4-10/h3-8H,2,9H2,1H3,(H,16,19)(H,17,18).
What are the key properties of 2-ethyl-6-oxo-N-(pyridin-4-ylmethyl)-1H-pyridine-4-carboxamide?
2-ethyl-6-oxo-N-(pyridin-4-ylmethyl)-1H-pyridine-4-carboxamide has a molecular weight of 257.29 g/mol, XLogP of 1.26, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-6-oxo-N-(pyridin-4-ylmethyl)-1H-pyridine-4-carboxamide is sourced from PubChem (CID 74237283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).