[(1S,3R)-3-(methylamino)cyclopentyl]methanol

C7H15NO — CID 12702526

IUPAC[(1S,3R)-3-(methylamino)cyclopentyl]methanol
SMILESCN[C@@H]1CC[C@H](CO)C1
InChIInChI=1S/C7H15NO/c1-8-7-3-2-6(4-7)5-9/h6-9H,2-5H2,1H3/t6-,7+/m0/s1
InChIKeyHMXFNXYNNYRFJK-NKWVEPMBSA-N
MW129.20 g/mol
LogP0.37
Rot. Bonds2

About [(1S,3R)-3-(methylamino)cyclopentyl]methanol

[(1S,3R)-3-(methylamino)cyclopentyl]methanol (PubChem CID 12702526) has the molecular formula C7H15NO and a molecular weight of 129.20 g/mol. Its IUPAC name is [(1S,3R)-3-(methylamino)cyclopentyl]methanol.

Molecular Properties

Compound Name[(1S,3R)-3-(methylamino)cyclopentyl]methanol
PubChem CID12702526
Molecular FormulaC7H15NO
Molecular Weight129.20 g/mol
Exact Mass129.12
IUPAC Name[(1S,3R)-3-(methylamino)cyclopentyl]methanol
SMILESCN[C@@H]1CC[C@H](CO)C1
InChIInChI=1S/C7H15NO/c1-8-7-3-2-6(4-7)5-9/h6-9H,2-5H2,1H3/t6-,7+/m0/s1
InChIKeyHMXFNXYNNYRFJK-NKWVEPMBSA-N
XLogP0.37
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.20
LogP ≤ 50.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [(1S,3R)-3-(methylamino)cyclopentyl]methanol?
The IUPAC name of [(1S,3R)-3-(methylamino)cyclopentyl]methanol (CID 12702526) is [(1S,3R)-3-(methylamino)cyclopentyl]methanol.
What is the SMILES notation for [(1S,3R)-3-(methylamino)cyclopentyl]methanol?
The canonical SMILES for [(1S,3R)-3-(methylamino)cyclopentyl]methanol is CN[C@@H]1CC[C@H](CO)C1.
What is the InChIKey of [(1S,3R)-3-(methylamino)cyclopentyl]methanol?
The InChIKey is HMXFNXYNNYRFJK-NKWVEPMBSA-N. The full InChI is InChI=1S/C7H15NO/c1-8-7-3-2-6(4-7)5-9/h6-9H,2-5H2,1H3/t6-,7+/m0/s1.
What are the key properties of [(1S,3R)-3-(methylamino)cyclopentyl]methanol?
[(1S,3R)-3-(methylamino)cyclopentyl]methanol has a molecular weight of 129.20 g/mol, XLogP of 0.37, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(1S,3R)-3-(methylamino)cyclopentyl]methanol is sourced from PubChem (CID 12702526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).