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

C11H22ClN — CID 138044580

IUPACN-methyl-1-spiro[3.5]nonan-9-ylmethanamine;hydrochloride
SMILESCNCC1CCCCC12CCC2.Cl
InChIInChI=1S/C11H21N.ClH/c1-12-9-10-5-2-3-6-11(10)7-4-8-11;/h10,12H,2-9H2,1H3;1H
InChIKeyKGWJKDQHIQSZFD-UHFFFAOYSA-N
MW203.76 g/mol
LogP2.99
Rot. Bonds2

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

N-methyl-1-spiro[3.5]nonan-9-ylmethanamine;hydrochloride (PubChem CID 138044580) has the molecular formula C11H22ClN and a molecular weight of 203.76 g/mol. Its IUPAC name is N-methyl-1-spiro[3.5]nonan-9-ylmethanamine;hydrochloride.

Molecular Properties

Compound NameN-methyl-1-spiro[3.5]nonan-9-ylmethanamine;hydrochloride
PubChem CID138044580
Molecular FormulaC11H22ClN
Molecular Weight203.76 g/mol
Exact Mass203.14
IUPAC NameN-methyl-1-spiro[3.5]nonan-9-ylmethanamine;hydrochloride
SMILESCNCC1CCCCC12CCC2.Cl
InChIInChI=1S/C11H21N.ClH/c1-12-9-10-5-2-3-6-11(10)7-4-8-11;/h10,12H,2-9H2,1H3;1H
InChIKeyKGWJKDQHIQSZFD-UHFFFAOYSA-N
XLogP2.99
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.76
LogP ≤ 52.99
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;hydrochloride?
The IUPAC name of N-methyl-1-spiro[3.5]nonan-9-ylmethanamine;hydrochloride (CID 138044580) is N-methyl-1-spiro[3.5]nonan-9-ylmethanamine;hydrochloride.
What is the SMILES notation for N-methyl-1-spiro[3.5]nonan-9-ylmethanamine;hydrochloride?
The canonical SMILES for N-methyl-1-spiro[3.5]nonan-9-ylmethanamine;hydrochloride is CNCC1CCCCC12CCC2.Cl.
What is the InChIKey of N-methyl-1-spiro[3.5]nonan-9-ylmethanamine;hydrochloride?
The InChIKey is KGWJKDQHIQSZFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N.ClH/c1-12-9-10-5-2-3-6-11(10)7-4-8-11;/h10,12H,2-9H2,1H3;1H.
What are the key properties of N-methyl-1-spiro[3.5]nonan-9-ylmethanamine;hydrochloride?
N-methyl-1-spiro[3.5]nonan-9-ylmethanamine;hydrochloride has a molecular weight of 203.76 g/mol, XLogP of 2.99, 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;hydrochloride is sourced from PubChem (CID 138044580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).