[(1S,3R)-3-aminocyclopentyl]methanol;hydrochloride

C6H14ClNO — CID 138040378

IUPAC[(1S,3R)-3-aminocyclopentyl]methanol;hydrochloride
SMILESCl.N[C@@H]1CC[C@H](CO)C1
InChIInChI=1S/C6H13NO.ClH/c7-6-2-1-5(3-6)4-8;/h5-6,8H,1-4,7H2;1H/t5-,6+;/m0./s1
InChIKeyQXSRCFAPVVTLBT-RIHPBJNCSA-N
MW151.64 g/mol
LogP0.53
Rot. Bonds1

About [(1S,3R)-3-aminocyclopentyl]methanol;hydrochloride

[(1S,3R)-3-aminocyclopentyl]methanol;hydrochloride (PubChem CID 138040378) has the molecular formula C6H14ClNO and a molecular weight of 151.64 g/mol. Its IUPAC name is [(1S,3R)-3-aminocyclopentyl]methanol;hydrochloride.

Molecular Properties

Compound Name[(1S,3R)-3-aminocyclopentyl]methanol;hydrochloride
PubChem CID138040378
Molecular FormulaC6H14ClNO
Molecular Weight151.64 g/mol
Exact Mass151.08
IUPAC Name[(1S,3R)-3-aminocyclopentyl]methanol;hydrochloride
SMILESCl.N[C@@H]1CC[C@H](CO)C1
InChIInChI=1S/C6H13NO.ClH/c7-6-2-1-5(3-6)4-8;/h5-6,8H,1-4,7H2;1H/t5-,6+;/m0./s1
InChIKeyQXSRCFAPVVTLBT-RIHPBJNCSA-N
XLogP0.53
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.64
LogP ≤ 50.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [(1S,3R)-3-aminocyclopentyl]methanol;hydrochloride?
The IUPAC name of [(1S,3R)-3-aminocyclopentyl]methanol;hydrochloride (CID 138040378) is [(1S,3R)-3-aminocyclopentyl]methanol;hydrochloride.
What is the SMILES notation for [(1S,3R)-3-aminocyclopentyl]methanol;hydrochloride?
The canonical SMILES for [(1S,3R)-3-aminocyclopentyl]methanol;hydrochloride is Cl.N[C@@H]1CC[C@H](CO)C1.
What is the InChIKey of [(1S,3R)-3-aminocyclopentyl]methanol;hydrochloride?
The InChIKey is QXSRCFAPVVTLBT-RIHPBJNCSA-N. The full InChI is InChI=1S/C6H13NO.ClH/c7-6-2-1-5(3-6)4-8;/h5-6,8H,1-4,7H2;1H/t5-,6+;/m0./s1.
What are the key properties of [(1S,3R)-3-aminocyclopentyl]methanol;hydrochloride?
[(1S,3R)-3-aminocyclopentyl]methanol;hydrochloride has a molecular weight of 151.64 g/mol, XLogP of 0.53, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(1S,3R)-3-aminocyclopentyl]methanol;hydrochloride is sourced from PubChem (CID 138040378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).