(6S)-4-azaspiro[2.4]heptan-6-ol;hydrochloride

C6H12ClNO — CID 162342438

IUPAC(6S)-4-azaspiro[2.4]heptan-6-ol;hydrochloride
SMILESCl.O[C@@H]1CNC2(CC2)C1
InChIInChI=1S/C6H11NO.ClH/c8-5-3-6(1-2-6)7-4-5;/h5,7-8H,1-4H2;1H/t5-;/m0./s1
InChIKeyMOTMWSSHRXPVKA-JEDNCBNOSA-N
MW149.62 g/mol
LogP0.29
Rot. Bonds

About (6S)-4-azaspiro[2.4]heptan-6-ol;hydrochloride

(6S)-4-azaspiro[2.4]heptan-6-ol;hydrochloride (PubChem CID 162342438) has the molecular formula C6H12ClNO and a molecular weight of 149.62 g/mol. Its IUPAC name is (6S)-4-azaspiro[2.4]heptan-6-ol;hydrochloride.

Molecular Properties

Compound Name(6S)-4-azaspiro[2.4]heptan-6-ol;hydrochloride
PubChem CID162342438
Molecular FormulaC6H12ClNO
Molecular Weight149.62 g/mol
Exact Mass149.06
IUPAC Name(6S)-4-azaspiro[2.4]heptan-6-ol;hydrochloride
SMILESCl.O[C@@H]1CNC2(CC2)C1
InChIInChI=1S/C6H11NO.ClH/c8-5-3-6(1-2-6)7-4-5;/h5,7-8H,1-4H2;1H/t5-;/m0./s1
InChIKeyMOTMWSSHRXPVKA-JEDNCBNOSA-N
XLogP0.29
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.62
LogP ≤ 50.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (6S)-4-azaspiro[2.4]heptan-6-ol;hydrochloride?
The IUPAC name of (6S)-4-azaspiro[2.4]heptan-6-ol;hydrochloride (CID 162342438) is (6S)-4-azaspiro[2.4]heptan-6-ol;hydrochloride.
What is the SMILES notation for (6S)-4-azaspiro[2.4]heptan-6-ol;hydrochloride?
The canonical SMILES for (6S)-4-azaspiro[2.4]heptan-6-ol;hydrochloride is Cl.O[C@@H]1CNC2(CC2)C1.
What is the InChIKey of (6S)-4-azaspiro[2.4]heptan-6-ol;hydrochloride?
The InChIKey is MOTMWSSHRXPVKA-JEDNCBNOSA-N. The full InChI is InChI=1S/C6H11NO.ClH/c8-5-3-6(1-2-6)7-4-5;/h5,7-8H,1-4H2;1H/t5-;/m0./s1.
What are the key properties of (6S)-4-azaspiro[2.4]heptan-6-ol;hydrochloride?
(6S)-4-azaspiro[2.4]heptan-6-ol;hydrochloride has a molecular weight of 149.62 g/mol, XLogP of 0.29, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6S)-4-azaspiro[2.4]heptan-6-ol;hydrochloride is sourced from PubChem (CID 162342438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).