N-(6-ethyl-1,2,3,4-tetrahydronaphthalen-2-yl)-5-[2-(oxolan-2-yl)ethyl]pyridine-2-carboxamide

C24H30N2O2 — CID 143761523

IUPACN-(6-ethyl-1,2,3,4-tetrahydronaphthalen-2-yl)-5-[2-(oxolan-2-yl)ethyl]pyridine-2-carboxamide
SMILESCCc1ccc2c(c1)CCC(NC(=O)c1ccc(CCC3CCCO3)cn1)C2
InChIInChI=1S/C24H30N2O2/c1-2-17-5-8-20-15-21(10-9-19(20)14-17)26-24(27)23-12-7-18(16-25-23)6-11-22-4-3-13-28-22/h5,7-8,12,14,16,21-22H,2-4,6,9-11,13,15H2,1H3,(H,26,27)
InChIKeyJCNCTCHJILPXPA-UHFFFAOYSA-N
MW378.52 g/mol
LogP4.04
Rot. Bonds6

About N-(6-ethyl-1,2,3,4-tetrahydronaphthalen-2-yl)-5-[2-(oxolan-2-yl)ethyl]pyridine-2-carboxamide

N-(6-ethyl-1,2,3,4-tetrahydronaphthalen-2-yl)-5-[2-(oxolan-2-yl)ethyl]pyridine-2-carboxamide (PubChem CID 143761523) has the molecular formula C24H30N2O2 and a molecular weight of 378.52 g/mol. Its IUPAC name is N-(6-ethyl-1,2,3,4-tetrahydronaphthalen-2-yl)-5-[2-(oxolan-2-yl)ethyl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(6-ethyl-1,2,3,4-tetrahydronaphthalen-2-yl)-5-[2-(oxolan-2-yl)ethyl]pyridine-2-carboxamide
PubChem CID143761523
Molecular FormulaC24H30N2O2
Molecular Weight378.52 g/mol
Exact Mass378.23
IUPAC NameN-(6-ethyl-1,2,3,4-tetrahydronaphthalen-2-yl)-5-[2-(oxolan-2-yl)ethyl]pyridine-2-carboxamide
SMILESCCc1ccc2c(c1)CCC(NC(=O)c1ccc(CCC3CCCO3)cn1)C2
InChIInChI=1S/C24H30N2O2/c1-2-17-5-8-20-15-21(10-9-19(20)14-17)26-24(27)23-12-7-18(16-25-23)6-11-22-4-3-13-28-22/h5,7-8,12,14,16,21-22H,2-4,6,9-11,13,15H2,1H3,(H,26,27)
InChIKeyJCNCTCHJILPXPA-UHFFFAOYSA-N
XLogP4.04
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.52
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(6-ethyl-1,2,3,4-tetrahydronaphthalen-2-yl)-5-[2-(oxolan-2-yl)ethyl]pyridine-2-carboxamide?
The IUPAC name of N-(6-ethyl-1,2,3,4-tetrahydronaphthalen-2-yl)-5-[2-(oxolan-2-yl)ethyl]pyridine-2-carboxamide (CID 143761523) is N-(6-ethyl-1,2,3,4-tetrahydronaphthalen-2-yl)-5-[2-(oxolan-2-yl)ethyl]pyridine-2-carboxamide.
What is the SMILES notation for N-(6-ethyl-1,2,3,4-tetrahydronaphthalen-2-yl)-5-[2-(oxolan-2-yl)ethyl]pyridine-2-carboxamide?
The canonical SMILES for N-(6-ethyl-1,2,3,4-tetrahydronaphthalen-2-yl)-5-[2-(oxolan-2-yl)ethyl]pyridine-2-carboxamide is CCc1ccc2c(c1)CCC(NC(=O)c1ccc(CCC3CCCO3)cn1)C2.
What is the InChIKey of N-(6-ethyl-1,2,3,4-tetrahydronaphthalen-2-yl)-5-[2-(oxolan-2-yl)ethyl]pyridine-2-carboxamide?
The InChIKey is JCNCTCHJILPXPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30N2O2/c1-2-17-5-8-20-15-21(10-9-19(20)14-17)26-24(27)23-12-7-18(16-25-23)6-11-22-4-3-13-28-22/h5,7-8,12,14,16,21-22H,2-4,6,9-11,13,15H2,1H3,(H,26,27).
What are the key properties of N-(6-ethyl-1,2,3,4-tetrahydronaphthalen-2-yl)-5-[2-(oxolan-2-yl)ethyl]pyridine-2-carboxamide?
N-(6-ethyl-1,2,3,4-tetrahydronaphthalen-2-yl)-5-[2-(oxolan-2-yl)ethyl]pyridine-2-carboxamide has a molecular weight of 378.52 g/mol, XLogP of 4.04, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-ethyl-1,2,3,4-tetrahydronaphthalen-2-yl)-5-[2-(oxolan-2-yl)ethyl]pyridine-2-carboxamide is sourced from PubChem (CID 143761523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).