1-(2-bicyclo[2.2.1]heptanyl)-N-methylmethanamine

C9H17N — CID 13265551

IUPAC1-(2-bicyclo[2.2.1]heptanyl)-N-methylmethanamine
SMILESCNCC1CC2CCC1C2
InChIInChI=1S/C9H17N/c1-10-6-9-5-7-2-3-8(9)4-7/h7-10H,2-6H2,1H3
InChIKeyLAWSJMJMIAHMMC-UHFFFAOYSA-N
MW139.24 g/mol
LogP1.64
Rot. Bonds2

About 1-(2-bicyclo[2.2.1]heptanyl)-N-methylmethanamine

1-(2-bicyclo[2.2.1]heptanyl)-N-methylmethanamine (PubChem CID 13265551) has the molecular formula C9H17N and a molecular weight of 139.24 g/mol. Its IUPAC name is 1-(2-bicyclo[2.2.1]heptanyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(2-bicyclo[2.2.1]heptanyl)-N-methylmethanamine
PubChem CID13265551
Molecular FormulaC9H17N
Molecular Weight139.24 g/mol
Exact Mass139.14
IUPAC Name1-(2-bicyclo[2.2.1]heptanyl)-N-methylmethanamine
SMILESCNCC1CC2CCC1C2
InChIInChI=1S/C9H17N/c1-10-6-9-5-7-2-3-8(9)4-7/h7-10H,2-6H2,1H3
InChIKeyLAWSJMJMIAHMMC-UHFFFAOYSA-N
XLogP1.64
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.24
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(2-bicyclo[2.2.1]heptanyl)-N-methylmethanamine?
The IUPAC name of 1-(2-bicyclo[2.2.1]heptanyl)-N-methylmethanamine (CID 13265551) is 1-(2-bicyclo[2.2.1]heptanyl)-N-methylmethanamine.
What is the SMILES notation for 1-(2-bicyclo[2.2.1]heptanyl)-N-methylmethanamine?
The canonical SMILES for 1-(2-bicyclo[2.2.1]heptanyl)-N-methylmethanamine is CNCC1CC2CCC1C2.
What is the InChIKey of 1-(2-bicyclo[2.2.1]heptanyl)-N-methylmethanamine?
The InChIKey is LAWSJMJMIAHMMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N/c1-10-6-9-5-7-2-3-8(9)4-7/h7-10H,2-6H2,1H3.
What are the key properties of 1-(2-bicyclo[2.2.1]heptanyl)-N-methylmethanamine?
1-(2-bicyclo[2.2.1]heptanyl)-N-methylmethanamine has a molecular weight of 139.24 g/mol, XLogP of 1.64, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-bicyclo[2.2.1]heptanyl)-N-methylmethanamine is sourced from PubChem (CID 13265551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).