N-methylcyclooctanamine

C9H19N — CID 4165815

IUPACN-methylcyclooctanamine
SMILESCNC1CCCCCCC1
InChIInChI=1S/C9H19N/c1-10-9-7-5-3-2-4-6-8-9/h9-10H,2-8H2,1H3
InChIKeyKSWJKWKZMNCDJF-UHFFFAOYSA-N
MW141.26 g/mol
LogP2.32
Rot. Bonds1

About N-methylcyclooctanamine

N-methylcyclooctanamine (PubChem CID 4165815) has the molecular formula C9H19N and a molecular weight of 141.26 g/mol. Its IUPAC name is N-methylcyclooctanamine.

Molecular Properties

Compound NameN-methylcyclooctanamine
PubChem CID4165815
Molecular FormulaC9H19N
Molecular Weight141.26 g/mol
Exact Mass141.15
IUPAC NameN-methylcyclooctanamine
SMILESCNC1CCCCCCC1
InChIInChI=1S/C9H19N/c1-10-9-7-5-3-2-4-6-8-9/h9-10H,2-8H2,1H3
InChIKeyKSWJKWKZMNCDJF-UHFFFAOYSA-N
XLogP2.32
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.26
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-methylcyclooctanamine?
The IUPAC name of N-methylcyclooctanamine (CID 4165815) is N-methylcyclooctanamine.
What is the SMILES notation for N-methylcyclooctanamine?
The canonical SMILES for N-methylcyclooctanamine is CNC1CCCCCCC1.
What is the InChIKey of N-methylcyclooctanamine?
The InChIKey is KSWJKWKZMNCDJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N/c1-10-9-7-5-3-2-4-6-8-9/h9-10H,2-8H2,1H3.
What are the key properties of N-methylcyclooctanamine?
N-methylcyclooctanamine has a molecular weight of 141.26 g/mol, XLogP of 2.32, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methylcyclooctanamine is sourced from PubChem (CID 4165815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).