(1R)-1-[5-(2-propan-2-ylpyrrolidin-1-yl)-2-pyridinyl]ethanol

C14H22N2O — CID 83131400

IUPAC(1R)-1-[5-(2-propan-2-ylpyrrolidin-1-yl)-2-pyridinyl]ethanol
SMILESCC(C)C1CCCN1c1ccc([C@@H](C)O)nc1
InChIInChI=1S/C14H22N2O/c1-10(2)14-5-4-8-16(14)12-6-7-13(11(3)17)15-9-12/h6-7,9-11,14,17H,4-5,8H2,1-3H3/t11-,14?/m1/s1
InChIKeyGLVKIRZWWWDPEI-YNODCEANSA-N
MW234.34 g/mol
LogP2.76
Rot. Bonds3

About (1R)-1-[5-(2-propan-2-ylpyrrolidin-1-yl)-2-pyridinyl]ethanol

(1R)-1-[5-(2-propan-2-ylpyrrolidin-1-yl)-2-pyridinyl]ethanol (PubChem CID 83131400) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is (1R)-1-[5-(2-propan-2-ylpyrrolidin-1-yl)-2-pyridinyl]ethanol.

Molecular Properties

Compound Name(1R)-1-[5-(2-propan-2-ylpyrrolidin-1-yl)-2-pyridinyl]ethanol
PubChem CID83131400
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name(1R)-1-[5-(2-propan-2-ylpyrrolidin-1-yl)-2-pyridinyl]ethanol
SMILESCC(C)C1CCCN1c1ccc([C@@H](C)O)nc1
InChIInChI=1S/C14H22N2O/c1-10(2)14-5-4-8-16(14)12-6-7-13(11(3)17)15-9-12/h6-7,9-11,14,17H,4-5,8H2,1-3H3/t11-,14?/m1/s1
InChIKeyGLVKIRZWWWDPEI-YNODCEANSA-N
XLogP2.76
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (1R)-1-[5-(2-propan-2-ylpyrrolidin-1-yl)-2-pyridinyl]ethanol?
The IUPAC name of (1R)-1-[5-(2-propan-2-ylpyrrolidin-1-yl)-2-pyridinyl]ethanol (CID 83131400) is (1R)-1-[5-(2-propan-2-ylpyrrolidin-1-yl)-2-pyridinyl]ethanol.
What is the SMILES notation for (1R)-1-[5-(2-propan-2-ylpyrrolidin-1-yl)-2-pyridinyl]ethanol?
The canonical SMILES for (1R)-1-[5-(2-propan-2-ylpyrrolidin-1-yl)-2-pyridinyl]ethanol is CC(C)C1CCCN1c1ccc([C@@H](C)O)nc1.
What is the InChIKey of (1R)-1-[5-(2-propan-2-ylpyrrolidin-1-yl)-2-pyridinyl]ethanol?
The InChIKey is GLVKIRZWWWDPEI-YNODCEANSA-N. The full InChI is InChI=1S/C14H22N2O/c1-10(2)14-5-4-8-16(14)12-6-7-13(11(3)17)15-9-12/h6-7,9-11,14,17H,4-5,8H2,1-3H3/t11-,14?/m1/s1.
What are the key properties of (1R)-1-[5-(2-propan-2-ylpyrrolidin-1-yl)-2-pyridinyl]ethanol?
(1R)-1-[5-(2-propan-2-ylpyrrolidin-1-yl)-2-pyridinyl]ethanol has a molecular weight of 234.34 g/mol, XLogP of 2.76, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[5-(2-propan-2-ylpyrrolidin-1-yl)-2-pyridinyl]ethanol is sourced from PubChem (CID 83131400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).