N,4,7,7-tetramethyl-3-oxobicyclo[2.2.1]heptane-1-carboxamide

C12H19NO2 — CID 2951177

IUPACN,4,7,7-tetramethyl-3-oxobicyclo[2.2.1]heptane-1-carboxamide
SMILESCNC(=O)C12CCC(C)(C(=O)C1)C2(C)C
InChIInChI=1S/C12H19NO2/c1-10(2)11(3)5-6-12(10,7-8(11)14)9(15)13-4/h5-7H2,1-4H3,(H,13,15)
InChIKeyNSPDFRLISGBBCU-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.52
Rot. Bonds1

About N,4,7,7-tetramethyl-3-oxobicyclo[2.2.1]heptane-1-carboxamide

N,4,7,7-tetramethyl-3-oxobicyclo[2.2.1]heptane-1-carboxamide (PubChem CID 2951177) has the molecular formula C12H19NO2 and a molecular weight of 209.29 g/mol. Its IUPAC name is N,4,7,7-tetramethyl-3-oxobicyclo[2.2.1]heptane-1-carboxamide.

Molecular Properties

Compound NameN,4,7,7-tetramethyl-3-oxobicyclo[2.2.1]heptane-1-carboxamide
PubChem CID2951177
Molecular FormulaC12H19NO2
Molecular Weight209.29 g/mol
Exact Mass209.14
IUPAC NameN,4,7,7-tetramethyl-3-oxobicyclo[2.2.1]heptane-1-carboxamide
SMILESCNC(=O)C12CCC(C)(C(=O)C1)C2(C)C
InChIInChI=1S/C12H19NO2/c1-10(2)11(3)5-6-12(10,7-8(11)14)9(15)13-4/h5-7H2,1-4H3,(H,13,15)
InChIKeyNSPDFRLISGBBCU-UHFFFAOYSA-N
XLogP1.52
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N,4,7,7-tetramethyl-3-oxobicyclo[2.2.1]heptane-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N,4,7,7-tetramethyl-3-oxobicyclo[2.2.1]heptane-1-carboxamide?
The IUPAC name of N,4,7,7-tetramethyl-3-oxobicyclo[2.2.1]heptane-1-carboxamide (CID 2951177) is N,4,7,7-tetramethyl-3-oxobicyclo[2.2.1]heptane-1-carboxamide.
What is the SMILES notation for N,4,7,7-tetramethyl-3-oxobicyclo[2.2.1]heptane-1-carboxamide?
The canonical SMILES for N,4,7,7-tetramethyl-3-oxobicyclo[2.2.1]heptane-1-carboxamide is CNC(=O)C12CCC(C)(C(=O)C1)C2(C)C.
What is the InChIKey of N,4,7,7-tetramethyl-3-oxobicyclo[2.2.1]heptane-1-carboxamide?
The InChIKey is NSPDFRLISGBBCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO2/c1-10(2)11(3)5-6-12(10,7-8(11)14)9(15)13-4/h5-7H2,1-4H3,(H,13,15).
What are the key properties of N,4,7,7-tetramethyl-3-oxobicyclo[2.2.1]heptane-1-carboxamide?
N,4,7,7-tetramethyl-3-oxobicyclo[2.2.1]heptane-1-carboxamide has a molecular weight of 209.29 g/mol, XLogP of 1.52, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,4,7,7-tetramethyl-3-oxobicyclo[2.2.1]heptane-1-carboxamide is sourced from PubChem (CID 2951177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).