[2-[(1-methylpiperidin-3-yl)methylamino]cyclopentyl]methanol

C13H26N2O — CID 106359457

IUPAC[2-[(1-methylpiperidin-3-yl)methylamino]cyclopentyl]methanol
SMILESCN1CCCC(CNC2CCCC2CO)C1
InChIInChI=1S/C13H26N2O/c1-15-7-3-4-11(9-15)8-14-13-6-2-5-12(13)10-16/h11-14,16H,2-10H2,1H3
InChIKeyRNCXZMIURAWRAG-UHFFFAOYSA-N
MW226.36 g/mol
LogP1.08
Rot. Bonds4

About [2-[(1-methylpiperidin-3-yl)methylamino]cyclopentyl]methanol

[2-[(1-methylpiperidin-3-yl)methylamino]cyclopentyl]methanol (PubChem CID 106359457) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is [2-[(1-methylpiperidin-3-yl)methylamino]cyclopentyl]methanol.

Molecular Properties

Compound Name[2-[(1-methylpiperidin-3-yl)methylamino]cyclopentyl]methanol
PubChem CID106359457
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name[2-[(1-methylpiperidin-3-yl)methylamino]cyclopentyl]methanol
SMILESCN1CCCC(CNC2CCCC2CO)C1
InChIInChI=1S/C13H26N2O/c1-15-7-3-4-11(9-15)8-14-13-6-2-5-12(13)10-16/h11-14,16H,2-10H2,1H3
InChIKeyRNCXZMIURAWRAG-UHFFFAOYSA-N
XLogP1.08
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [2-[(1-methylpiperidin-3-yl)methylamino]cyclopentyl]methanol?
The IUPAC name of [2-[(1-methylpiperidin-3-yl)methylamino]cyclopentyl]methanol (CID 106359457) is [2-[(1-methylpiperidin-3-yl)methylamino]cyclopentyl]methanol.
What is the SMILES notation for [2-[(1-methylpiperidin-3-yl)methylamino]cyclopentyl]methanol?
The canonical SMILES for [2-[(1-methylpiperidin-3-yl)methylamino]cyclopentyl]methanol is CN1CCCC(CNC2CCCC2CO)C1.
What is the InChIKey of [2-[(1-methylpiperidin-3-yl)methylamino]cyclopentyl]methanol?
The InChIKey is RNCXZMIURAWRAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-15-7-3-4-11(9-15)8-14-13-6-2-5-12(13)10-16/h11-14,16H,2-10H2,1H3.
What are the key properties of [2-[(1-methylpiperidin-3-yl)methylamino]cyclopentyl]methanol?
[2-[(1-methylpiperidin-3-yl)methylamino]cyclopentyl]methanol has a molecular weight of 226.36 g/mol, XLogP of 1.08, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(1-methylpiperidin-3-yl)methylamino]cyclopentyl]methanol is sourced from PubChem (CID 106359457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).