bicyclo[3.2.0]heptane-3-carboxamide

C8H13NO — CID 53431016

IUPACbicyclo[3.2.0]heptane-3-carboxamide
SMILESNC(=O)C1CC2CCC2C1
InChIInChI=1S/C8H13NO/c9-8(10)7-3-5-1-2-6(5)4-7/h5-7H,1-4H2,(H2,9,10)
InChIKeyDTDLJVBXWQKGQN-UHFFFAOYSA-N
MW139.20 g/mol
LogP0.91
Rot. Bonds1

About bicyclo[3.2.0]heptane-3-carboxamide

bicyclo[3.2.0]heptane-3-carboxamide (PubChem CID 53431016) has the molecular formula C8H13NO and a molecular weight of 139.20 g/mol. Its IUPAC name is bicyclo[3.2.0]heptane-3-carboxamide.

Molecular Properties

Compound Namebicyclo[3.2.0]heptane-3-carboxamide
PubChem CID53431016
Molecular FormulaC8H13NO
Molecular Weight139.20 g/mol
Exact Mass139.10
IUPAC Namebicyclo[3.2.0]heptane-3-carboxamide
SMILESNC(=O)C1CC2CCC2C1
InChIInChI=1S/C8H13NO/c9-8(10)7-3-5-1-2-6(5)4-7/h5-7H,1-4H2,(H2,9,10)
InChIKeyDTDLJVBXWQKGQN-UHFFFAOYSA-N
XLogP0.91
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.20
LogP ≤ 50.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of bicyclo[3.2.0]heptane-3-carboxamide?
The IUPAC name of bicyclo[3.2.0]heptane-3-carboxamide (CID 53431016) is bicyclo[3.2.0]heptane-3-carboxamide.
What is the SMILES notation for bicyclo[3.2.0]heptane-3-carboxamide?
The canonical SMILES for bicyclo[3.2.0]heptane-3-carboxamide is NC(=O)C1CC2CCC2C1.
What is the InChIKey of bicyclo[3.2.0]heptane-3-carboxamide?
The InChIKey is DTDLJVBXWQKGQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO/c9-8(10)7-3-5-1-2-6(5)4-7/h5-7H,1-4H2,(H2,9,10).
What are the key properties of bicyclo[3.2.0]heptane-3-carboxamide?
bicyclo[3.2.0]heptane-3-carboxamide has a molecular weight of 139.20 g/mol, XLogP of 0.91, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for bicyclo[3.2.0]heptane-3-carboxamide is sourced from PubChem (CID 53431016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).