[(2R)-2-methyl-4-(2-methylprop-2-enyl)piperidin-4-yl]methanol

C11H21NO — CID 156519126

IUPAC[(2R)-2-methyl-4-(2-methylprop-2-enyl)piperidin-4-yl]methanol
SMILESC=C(C)CC1(CO)CCN[C@H](C)C1
InChIInChI=1S/C11H21NO/c1-9(2)6-11(8-13)4-5-12-10(3)7-11/h10,12-13H,1,4-8H2,2-3H3/t10-,11?/m1/s1
InChIKeyXSBGSBDBDJPVRD-NFJWQWPMSA-N
MW183.29 g/mol
LogP1.70
Rot. Bonds3

About [(2R)-2-methyl-4-(2-methylprop-2-enyl)piperidin-4-yl]methanol

[(2R)-2-methyl-4-(2-methylprop-2-enyl)piperidin-4-yl]methanol (PubChem CID 156519126) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is [(2R)-2-methyl-4-(2-methylprop-2-enyl)piperidin-4-yl]methanol.

Molecular Properties

Compound Name[(2R)-2-methyl-4-(2-methylprop-2-enyl)piperidin-4-yl]methanol
PubChem CID156519126
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name[(2R)-2-methyl-4-(2-methylprop-2-enyl)piperidin-4-yl]methanol
SMILESC=C(C)CC1(CO)CCN[C@H](C)C1
InChIInChI=1S/C11H21NO/c1-9(2)6-11(8-13)4-5-12-10(3)7-11/h10,12-13H,1,4-8H2,2-3H3/t10-,11?/m1/s1
InChIKeyXSBGSBDBDJPVRD-NFJWQWPMSA-N
XLogP1.70
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [(2R)-2-methyl-4-(2-methylprop-2-enyl)piperidin-4-yl]methanol?
The IUPAC name of [(2R)-2-methyl-4-(2-methylprop-2-enyl)piperidin-4-yl]methanol (CID 156519126) is [(2R)-2-methyl-4-(2-methylprop-2-enyl)piperidin-4-yl]methanol.
What is the SMILES notation for [(2R)-2-methyl-4-(2-methylprop-2-enyl)piperidin-4-yl]methanol?
The canonical SMILES for [(2R)-2-methyl-4-(2-methylprop-2-enyl)piperidin-4-yl]methanol is C=C(C)CC1(CO)CCN[C@H](C)C1.
What is the InChIKey of [(2R)-2-methyl-4-(2-methylprop-2-enyl)piperidin-4-yl]methanol?
The InChIKey is XSBGSBDBDJPVRD-NFJWQWPMSA-N. The full InChI is InChI=1S/C11H21NO/c1-9(2)6-11(8-13)4-5-12-10(3)7-11/h10,12-13H,1,4-8H2,2-3H3/t10-,11?/m1/s1.
What are the key properties of [(2R)-2-methyl-4-(2-methylprop-2-enyl)piperidin-4-yl]methanol?
[(2R)-2-methyl-4-(2-methylprop-2-enyl)piperidin-4-yl]methanol has a molecular weight of 183.29 g/mol, XLogP of 1.70, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-2-methyl-4-(2-methylprop-2-enyl)piperidin-4-yl]methanol is sourced from PubChem (CID 156519126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).