1-aminobicyclo[2.2.1]heptane-2-carboxamide

C8H14N2O — CID 140580840

IUPAC1-aminobicyclo[2.2.1]heptane-2-carboxamide
SMILESNC(=O)C1CC2CCC1(N)C2
InChIInChI=1S/C8H14N2O/c9-7(11)6-3-5-1-2-8(6,10)4-5/h5-6H,1-4,10H2,(H2,9,11)
InChIKeyJTUUCLAQWXUXMI-UHFFFAOYSA-N
MW154.21 g/mol
LogP-0.01
Rot. Bonds1

About 1-aminobicyclo[2.2.1]heptane-2-carboxamide

1-aminobicyclo[2.2.1]heptane-2-carboxamide (PubChem CID 140580840) has the molecular formula C8H14N2O and a molecular weight of 154.21 g/mol. Its IUPAC name is 1-aminobicyclo[2.2.1]heptane-2-carboxamide.

Molecular Properties

Compound Name1-aminobicyclo[2.2.1]heptane-2-carboxamide
PubChem CID140580840
Molecular FormulaC8H14N2O
Molecular Weight154.21 g/mol
Exact Mass154.11
IUPAC Name1-aminobicyclo[2.2.1]heptane-2-carboxamide
SMILESNC(=O)C1CC2CCC1(N)C2
InChIInChI=1S/C8H14N2O/c9-7(11)6-3-5-1-2-8(6,10)4-5/h5-6H,1-4,10H2,(H2,9,11)
InChIKeyJTUUCLAQWXUXMI-UHFFFAOYSA-N
XLogP-0.01
TPSA69.11 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.21
LogP ≤ 5-0.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-aminobicyclo[2.2.1]heptane-2-carboxamide?
The IUPAC name of 1-aminobicyclo[2.2.1]heptane-2-carboxamide (CID 140580840) is 1-aminobicyclo[2.2.1]heptane-2-carboxamide.
What is the SMILES notation for 1-aminobicyclo[2.2.1]heptane-2-carboxamide?
The canonical SMILES for 1-aminobicyclo[2.2.1]heptane-2-carboxamide is NC(=O)C1CC2CCC1(N)C2.
What is the InChIKey of 1-aminobicyclo[2.2.1]heptane-2-carboxamide?
The InChIKey is JTUUCLAQWXUXMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O/c9-7(11)6-3-5-1-2-8(6,10)4-5/h5-6H,1-4,10H2,(H2,9,11).
What are the key properties of 1-aminobicyclo[2.2.1]heptane-2-carboxamide?
1-aminobicyclo[2.2.1]heptane-2-carboxamide has a molecular weight of 154.21 g/mol, XLogP of -0.01, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-aminobicyclo[2.2.1]heptane-2-carboxamide is sourced from PubChem (CID 140580840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).