N-methylspiro[2.3]hexan-5-amine;hydrochloride

C7H14ClN — CID 90020121

IUPACN-methylspiro[2.3]hexan-5-amine;hydrochloride
SMILESCNC1CC2(CC2)C1.Cl
InChIInChI=1S/C7H13N.ClH/c1-8-6-4-7(5-6)2-3-7;/h6,8H,2-5H2,1H3;1H
InChIKeyKQDSYUUMIVZXNE-UHFFFAOYSA-N
MW147.65 g/mol
LogP1.57
Rot. Bonds1

About N-methylspiro[2.3]hexan-5-amine;hydrochloride

N-methylspiro[2.3]hexan-5-amine;hydrochloride (PubChem CID 90020121) has the molecular formula C7H14ClN and a molecular weight of 147.65 g/mol. Its IUPAC name is N-methylspiro[2.3]hexan-5-amine;hydrochloride.

Molecular Properties

Compound NameN-methylspiro[2.3]hexan-5-amine;hydrochloride
PubChem CID90020121
Molecular FormulaC7H14ClN
Molecular Weight147.65 g/mol
Exact Mass147.08
IUPAC NameN-methylspiro[2.3]hexan-5-amine;hydrochloride
SMILESCNC1CC2(CC2)C1.Cl
InChIInChI=1S/C7H13N.ClH/c1-8-6-4-7(5-6)2-3-7;/h6,8H,2-5H2,1H3;1H
InChIKeyKQDSYUUMIVZXNE-UHFFFAOYSA-N
XLogP1.57
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.65
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-methylspiro[2.3]hexan-5-amine;hydrochloride?
The IUPAC name of N-methylspiro[2.3]hexan-5-amine;hydrochloride (CID 90020121) is N-methylspiro[2.3]hexan-5-amine;hydrochloride.
What is the SMILES notation for N-methylspiro[2.3]hexan-5-amine;hydrochloride?
The canonical SMILES for N-methylspiro[2.3]hexan-5-amine;hydrochloride is CNC1CC2(CC2)C1.Cl.
What is the InChIKey of N-methylspiro[2.3]hexan-5-amine;hydrochloride?
The InChIKey is KQDSYUUMIVZXNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N.ClH/c1-8-6-4-7(5-6)2-3-7;/h6,8H,2-5H2,1H3;1H.
What are the key properties of N-methylspiro[2.3]hexan-5-amine;hydrochloride?
N-methylspiro[2.3]hexan-5-amine;hydrochloride has a molecular weight of 147.65 g/mol, XLogP of 1.57, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methylspiro[2.3]hexan-5-amine;hydrochloride is sourced from PubChem (CID 90020121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).