2-[1-(methylamino)-2-piperidin-4-ylcyclopropyl]ethanol

C11H22N2O — CID 123354243

IUPAC2-[1-(methylamino)-2-piperidin-4-ylcyclopropyl]ethanol
SMILESCNC1(CCO)CC1C1CCNCC1
InChIInChI=1S/C11H22N2O/c1-12-11(4-7-14)8-10(11)9-2-5-13-6-3-9/h9-10,12-14H,2-8H2,1H3
InChIKeyVXQVXPDIBLLPRR-UHFFFAOYSA-N
MW198.31 g/mol
LogP0.35
Rot. Bonds4

About 2-[1-(methylamino)-2-piperidin-4-ylcyclopropyl]ethanol

2-[1-(methylamino)-2-piperidin-4-ylcyclopropyl]ethanol (PubChem CID 123354243) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is 2-[1-(methylamino)-2-piperidin-4-ylcyclopropyl]ethanol.

Molecular Properties

Compound Name2-[1-(methylamino)-2-piperidin-4-ylcyclopropyl]ethanol
PubChem CID123354243
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name2-[1-(methylamino)-2-piperidin-4-ylcyclopropyl]ethanol
SMILESCNC1(CCO)CC1C1CCNCC1
InChIInChI=1S/C11H22N2O/c1-12-11(4-7-14)8-10(11)9-2-5-13-6-3-9/h9-10,12-14H,2-8H2,1H3
InChIKeyVXQVXPDIBLLPRR-UHFFFAOYSA-N
XLogP0.35
TPSA44.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 50.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[1-(methylamino)-2-piperidin-4-ylcyclopropyl]ethanol?
The IUPAC name of 2-[1-(methylamino)-2-piperidin-4-ylcyclopropyl]ethanol (CID 123354243) is 2-[1-(methylamino)-2-piperidin-4-ylcyclopropyl]ethanol.
What is the SMILES notation for 2-[1-(methylamino)-2-piperidin-4-ylcyclopropyl]ethanol?
The canonical SMILES for 2-[1-(methylamino)-2-piperidin-4-ylcyclopropyl]ethanol is CNC1(CCO)CC1C1CCNCC1.
What is the InChIKey of 2-[1-(methylamino)-2-piperidin-4-ylcyclopropyl]ethanol?
The InChIKey is VXQVXPDIBLLPRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-12-11(4-7-14)8-10(11)9-2-5-13-6-3-9/h9-10,12-14H,2-8H2,1H3.
What are the key properties of 2-[1-(methylamino)-2-piperidin-4-ylcyclopropyl]ethanol?
2-[1-(methylamino)-2-piperidin-4-ylcyclopropyl]ethanol has a molecular weight of 198.31 g/mol, XLogP of 0.35, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(methylamino)-2-piperidin-4-ylcyclopropyl]ethanol is sourced from PubChem (CID 123354243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).