N-cycloheptyl-1,4,6-trimethyl-2-oxopyridine-3-carboxamide

C16H24N2O2 — CID 110855496

IUPACN-cycloheptyl-1,4,6-trimethyl-2-oxopyridine-3-carboxamide
SMILESCc1cc(C)n(C)c(=O)c1C(=O)NC1CCCCCC1
InChIInChI=1S/C16H24N2O2/c1-11-10-12(2)18(3)16(20)14(11)15(19)17-13-8-6-4-5-7-9-13/h10,13H,4-9H2,1-3H3,(H,17,19)
InChIKeyWJOKPBUYSARDSV-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.45
Rot. Bonds2

About N-cycloheptyl-1,4,6-trimethyl-2-oxopyridine-3-carboxamide

N-cycloheptyl-1,4,6-trimethyl-2-oxopyridine-3-carboxamide (PubChem CID 110855496) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is N-cycloheptyl-1,4,6-trimethyl-2-oxopyridine-3-carboxamide.

Molecular Properties

Compound NameN-cycloheptyl-1,4,6-trimethyl-2-oxopyridine-3-carboxamide
PubChem CID110855496
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC NameN-cycloheptyl-1,4,6-trimethyl-2-oxopyridine-3-carboxamide
SMILESCc1cc(C)n(C)c(=O)c1C(=O)NC1CCCCCC1
InChIInChI=1S/C16H24N2O2/c1-11-10-12(2)18(3)16(20)14(11)15(19)17-13-8-6-4-5-7-9-13/h10,13H,4-9H2,1-3H3,(H,17,19)
InChIKeyWJOKPBUYSARDSV-UHFFFAOYSA-N
XLogP2.45
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-1,4,6-trimethyl-2-oxopyridine-3-carboxamide?
The IUPAC name of N-cycloheptyl-1,4,6-trimethyl-2-oxopyridine-3-carboxamide (CID 110855496) is N-cycloheptyl-1,4,6-trimethyl-2-oxopyridine-3-carboxamide.
What is the SMILES notation for N-cycloheptyl-1,4,6-trimethyl-2-oxopyridine-3-carboxamide?
The canonical SMILES for N-cycloheptyl-1,4,6-trimethyl-2-oxopyridine-3-carboxamide is Cc1cc(C)n(C)c(=O)c1C(=O)NC1CCCCCC1.
What is the InChIKey of N-cycloheptyl-1,4,6-trimethyl-2-oxopyridine-3-carboxamide?
The InChIKey is WJOKPBUYSARDSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-11-10-12(2)18(3)16(20)14(11)15(19)17-13-8-6-4-5-7-9-13/h10,13H,4-9H2,1-3H3,(H,17,19).
What are the key properties of N-cycloheptyl-1,4,6-trimethyl-2-oxopyridine-3-carboxamide?
N-cycloheptyl-1,4,6-trimethyl-2-oxopyridine-3-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 2.45, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-1,4,6-trimethyl-2-oxopyridine-3-carboxamide is sourced from PubChem (CID 110855496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).