N-[2-(6-oxo-1H-pyridin-3-yl)propan-2-yl]tricyclo[4.3.0.02,4]nona-1(9),3,5,7-tetraene-7-carboxamide

C18H16N2O2 — CID 123373982

IUPACN-[2-(6-oxo-1H-pyridin-3-yl)propan-2-yl]tricyclo[4.3.0.02,4]nona-1(9),3,5,7-tetraene-7-carboxamide
SMILESCC(C)(NC(=O)C1=CC=C2C1=CC1=CC12)c1ccc(=O)[nH]c1
InChIInChI=1S/C18H16N2O2/c1-18(2,11-3-6-16(21)19-9-11)20-17(22)13-5-4-12-14-7-10(14)8-15(12)13/h3-9,14H,1-2H3,(H,19,21)(H,20,22)
InChIKeyGKGOKJLPWNCAMR-UHFFFAOYSA-N
MW292.34 g/mol
LogP2.09
Rot. Bonds3

About N-[2-(6-oxo-1H-pyridin-3-yl)propan-2-yl]tricyclo[4.3.0.02,4]nona-1(9),3,5,7-tetraene-7-carboxamide

N-[2-(6-oxo-1H-pyridin-3-yl)propan-2-yl]tricyclo[4.3.0.02,4]nona-1(9),3,5,7-tetraene-7-carboxamide (PubChem CID 123373982) has the molecular formula C18H16N2O2 and a molecular weight of 292.34 g/mol. Its IUPAC name is N-[2-(6-oxo-1H-pyridin-3-yl)propan-2-yl]tricyclo[4.3.0.02,4]nona-1(9),3,5,7-tetraene-7-carboxamide.

Molecular Properties

Compound NameN-[2-(6-oxo-1H-pyridin-3-yl)propan-2-yl]tricyclo[4.3.0.02,4]nona-1(9),3,5,7-tetraene-7-carboxamide
PubChem CID123373982
Molecular FormulaC18H16N2O2
Molecular Weight292.34 g/mol
Exact Mass292.12
IUPAC NameN-[2-(6-oxo-1H-pyridin-3-yl)propan-2-yl]tricyclo[4.3.0.02,4]nona-1(9),3,5,7-tetraene-7-carboxamide
SMILESCC(C)(NC(=O)C1=CC=C2C1=CC1=CC12)c1ccc(=O)[nH]c1
InChIInChI=1S/C18H16N2O2/c1-18(2,11-3-6-16(21)19-9-11)20-17(22)13-5-4-12-14-7-10(14)8-15(12)13/h3-9,14H,1-2H3,(H,19,21)(H,20,22)
InChIKeyGKGOKJLPWNCAMR-UHFFFAOYSA-N
XLogP2.09
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[2-(6-oxo-1H-pyridin-3-yl)propan-2-yl]tricyclo[4.3.0.02,4]nona-1(9),3,5,7-tetraene-7-carboxamide?
The IUPAC name of N-[2-(6-oxo-1H-pyridin-3-yl)propan-2-yl]tricyclo[4.3.0.02,4]nona-1(9),3,5,7-tetraene-7-carboxamide (CID 123373982) is N-[2-(6-oxo-1H-pyridin-3-yl)propan-2-yl]tricyclo[4.3.0.02,4]nona-1(9),3,5,7-tetraene-7-carboxamide.
What is the SMILES notation for N-[2-(6-oxo-1H-pyridin-3-yl)propan-2-yl]tricyclo[4.3.0.02,4]nona-1(9),3,5,7-tetraene-7-carboxamide?
The canonical SMILES for N-[2-(6-oxo-1H-pyridin-3-yl)propan-2-yl]tricyclo[4.3.0.02,4]nona-1(9),3,5,7-tetraene-7-carboxamide is CC(C)(NC(=O)C1=CC=C2C1=CC1=CC12)c1ccc(=O)[nH]c1.
What is the InChIKey of N-[2-(6-oxo-1H-pyridin-3-yl)propan-2-yl]tricyclo[4.3.0.02,4]nona-1(9),3,5,7-tetraene-7-carboxamide?
The InChIKey is GKGOKJLPWNCAMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O2/c1-18(2,11-3-6-16(21)19-9-11)20-17(22)13-5-4-12-14-7-10(14)8-15(12)13/h3-9,14H,1-2H3,(H,19,21)(H,20,22).
What are the key properties of N-[2-(6-oxo-1H-pyridin-3-yl)propan-2-yl]tricyclo[4.3.0.02,4]nona-1(9),3,5,7-tetraene-7-carboxamide?
N-[2-(6-oxo-1H-pyridin-3-yl)propan-2-yl]tricyclo[4.3.0.02,4]nona-1(9),3,5,7-tetraene-7-carboxamide has a molecular weight of 292.34 g/mol, XLogP of 2.09, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(6-oxo-1H-pyridin-3-yl)propan-2-yl]tricyclo[4.3.0.02,4]nona-1(9),3,5,7-tetraene-7-carboxamide is sourced from PubChem (CID 123373982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).