2-[(1-hydroxy-2-methylpropan-2-yl)-methylamino]cyclopentan-1-ol

C10H21NO2 — CID 115773230

IUPAC2-[(1-hydroxy-2-methylpropan-2-yl)-methylamino]cyclopentan-1-ol
SMILESCN(C1CCCC1O)C(C)(C)CO
InChIInChI=1S/C10H21NO2/c1-10(2,7-12)11(3)8-5-4-6-9(8)13/h8-9,12-13H,4-7H2,1-3H3
InChIKeyCYCGMYHQTNEPBR-UHFFFAOYSA-N
MW187.28 g/mol
LogP0.60
Rot. Bonds3

About 2-[(1-hydroxy-2-methylpropan-2-yl)-methylamino]cyclopentan-1-ol

2-[(1-hydroxy-2-methylpropan-2-yl)-methylamino]cyclopentan-1-ol (PubChem CID 115773230) has the molecular formula C10H21NO2 and a molecular weight of 187.28 g/mol. Its IUPAC name is 2-[(1-hydroxy-2-methylpropan-2-yl)-methylamino]cyclopentan-1-ol.

Molecular Properties

Compound Name2-[(1-hydroxy-2-methylpropan-2-yl)-methylamino]cyclopentan-1-ol
PubChem CID115773230
Molecular FormulaC10H21NO2
Molecular Weight187.28 g/mol
Exact Mass187.16
IUPAC Name2-[(1-hydroxy-2-methylpropan-2-yl)-methylamino]cyclopentan-1-ol
SMILESCN(C1CCCC1O)C(C)(C)CO
InChIInChI=1S/C10H21NO2/c1-10(2,7-12)11(3)8-5-4-6-9(8)13/h8-9,12-13H,4-7H2,1-3H3
InChIKeyCYCGMYHQTNEPBR-UHFFFAOYSA-N
XLogP0.60
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.28
LogP ≤ 50.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(1-hydroxy-2-methylpropan-2-yl)-methylamino]cyclopentan-1-ol?
The IUPAC name of 2-[(1-hydroxy-2-methylpropan-2-yl)-methylamino]cyclopentan-1-ol (CID 115773230) is 2-[(1-hydroxy-2-methylpropan-2-yl)-methylamino]cyclopentan-1-ol.
What is the SMILES notation for 2-[(1-hydroxy-2-methylpropan-2-yl)-methylamino]cyclopentan-1-ol?
The canonical SMILES for 2-[(1-hydroxy-2-methylpropan-2-yl)-methylamino]cyclopentan-1-ol is CN(C1CCCC1O)C(C)(C)CO.
What is the InChIKey of 2-[(1-hydroxy-2-methylpropan-2-yl)-methylamino]cyclopentan-1-ol?
The InChIKey is CYCGMYHQTNEPBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2/c1-10(2,7-12)11(3)8-5-4-6-9(8)13/h8-9,12-13H,4-7H2,1-3H3.
What are the key properties of 2-[(1-hydroxy-2-methylpropan-2-yl)-methylamino]cyclopentan-1-ol?
2-[(1-hydroxy-2-methylpropan-2-yl)-methylamino]cyclopentan-1-ol has a molecular weight of 187.28 g/mol, XLogP of 0.60, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1-hydroxy-2-methylpropan-2-yl)-methylamino]cyclopentan-1-ol is sourced from PubChem (CID 115773230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).