N-(6-oxo-1-propyl-3-pyridinyl)pyridine-4-carboxamide

C14H15N3O2 — CID 47328565

IUPACN-(6-oxo-1-propyl-3-pyridinyl)pyridine-4-carboxamide
SMILESCCCn1cc(NC(=O)c2ccncc2)ccc1=O
InChIInChI=1S/C14H15N3O2/c1-2-9-17-10-12(3-4-13(17)18)16-14(19)11-5-7-15-8-6-11/h3-8,10H,2,9H2,1H3,(H,16,19)
InChIKeyICYINOYUJMKTEP-UHFFFAOYSA-N
MW257.29 g/mol
LogP1.91
Rot. Bonds4

About N-(6-oxo-1-propyl-3-pyridinyl)pyridine-4-carboxamide

N-(6-oxo-1-propyl-3-pyridinyl)pyridine-4-carboxamide (PubChem CID 47328565) has the molecular formula C14H15N3O2 and a molecular weight of 257.29 g/mol. Its IUPAC name is N-(6-oxo-1-propyl-3-pyridinyl)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(6-oxo-1-propyl-3-pyridinyl)pyridine-4-carboxamide
PubChem CID47328565
Molecular FormulaC14H15N3O2
Molecular Weight257.29 g/mol
Exact Mass257.12
IUPAC NameN-(6-oxo-1-propyl-3-pyridinyl)pyridine-4-carboxamide
SMILESCCCn1cc(NC(=O)c2ccncc2)ccc1=O
InChIInChI=1S/C14H15N3O2/c1-2-9-17-10-12(3-4-13(17)18)16-14(19)11-5-7-15-8-6-11/h3-8,10H,2,9H2,1H3,(H,16,19)
InChIKeyICYINOYUJMKTEP-UHFFFAOYSA-N
XLogP1.91
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(6-oxo-1-propyl-3-pyridinyl)pyridine-4-carboxamide?
The IUPAC name of N-(6-oxo-1-propyl-3-pyridinyl)pyridine-4-carboxamide (CID 47328565) is N-(6-oxo-1-propyl-3-pyridinyl)pyridine-4-carboxamide.
What is the SMILES notation for N-(6-oxo-1-propyl-3-pyridinyl)pyridine-4-carboxamide?
The canonical SMILES for N-(6-oxo-1-propyl-3-pyridinyl)pyridine-4-carboxamide is CCCn1cc(NC(=O)c2ccncc2)ccc1=O.
What is the InChIKey of N-(6-oxo-1-propyl-3-pyridinyl)pyridine-4-carboxamide?
The InChIKey is ICYINOYUJMKTEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O2/c1-2-9-17-10-12(3-4-13(17)18)16-14(19)11-5-7-15-8-6-11/h3-8,10H,2,9H2,1H3,(H,16,19).
What are the key properties of N-(6-oxo-1-propyl-3-pyridinyl)pyridine-4-carboxamide?
N-(6-oxo-1-propyl-3-pyridinyl)pyridine-4-carboxamide has a molecular weight of 257.29 g/mol, XLogP of 1.91, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-oxo-1-propyl-3-pyridinyl)pyridine-4-carboxamide is sourced from PubChem (CID 47328565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).