N-methyl-1-spiro[3.5]nonan-9-ylmethanamine

C11H21N — CID 83905647

IUPACN-methyl-1-spiro[3.5]nonan-9-ylmethanamine
SMILESCNCC1CCCCC12CCC2
InChIInChI=1S/C11H21N/c1-12-9-10-5-2-3-6-11(10)7-4-8-11/h10,12H,2-9H2,1H3
InChIKeyCNIQUEUSHGDZKC-UHFFFAOYSA-N
MW167.30 g/mol
LogP2.57
Rot. Bonds2

About N-methyl-1-spiro[3.5]nonan-9-ylmethanamine

N-methyl-1-spiro[3.5]nonan-9-ylmethanamine (PubChem CID 83905647) has the molecular formula C11H21N and a molecular weight of 167.30 g/mol. Its IUPAC name is N-methyl-1-spiro[3.5]nonan-9-ylmethanamine.

Molecular Properties

Compound NameN-methyl-1-spiro[3.5]nonan-9-ylmethanamine
PubChem CID83905647
Molecular FormulaC11H21N
Molecular Weight167.30 g/mol
Exact Mass167.17
IUPAC NameN-methyl-1-spiro[3.5]nonan-9-ylmethanamine
SMILESCNCC1CCCCC12CCC2
InChIInChI=1S/C11H21N/c1-12-9-10-5-2-3-6-11(10)7-4-8-11/h10,12H,2-9H2,1H3
InChIKeyCNIQUEUSHGDZKC-UHFFFAOYSA-N
XLogP2.57
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.30
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-spiro[3.5]nonan-9-ylmethanamine?
The IUPAC name of N-methyl-1-spiro[3.5]nonan-9-ylmethanamine (CID 83905647) is N-methyl-1-spiro[3.5]nonan-9-ylmethanamine.
What is the SMILES notation for N-methyl-1-spiro[3.5]nonan-9-ylmethanamine?
The canonical SMILES for N-methyl-1-spiro[3.5]nonan-9-ylmethanamine is CNCC1CCCCC12CCC2.
What is the InChIKey of N-methyl-1-spiro[3.5]nonan-9-ylmethanamine?
The InChIKey is CNIQUEUSHGDZKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N/c1-12-9-10-5-2-3-6-11(10)7-4-8-11/h10,12H,2-9H2,1H3.
What are the key properties of N-methyl-1-spiro[3.5]nonan-9-ylmethanamine?
N-methyl-1-spiro[3.5]nonan-9-ylmethanamine has a molecular weight of 167.30 g/mol, XLogP of 2.57, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-spiro[3.5]nonan-9-ylmethanamine is sourced from PubChem (CID 83905647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).