(1R)-1-[5-(3-methoxy-3-methylpiperidin-1-yl)-2-pyridinyl]ethanol

C14H22N2O2 — CID 107393509

IUPAC(1R)-1-[5-(3-methoxy-3-methylpiperidin-1-yl)-2-pyridinyl]ethanol
SMILESCOC1(C)CCCN(c2ccc([C@@H](C)O)nc2)C1
InChIInChI=1S/C14H22N2O2/c1-11(17)13-6-5-12(9-15-13)16-8-4-7-14(2,10-16)18-3/h5-6,9,11,17H,4,7-8,10H2,1-3H3/t11-,14?/m1/s1
InChIKeyPWVUDOQHBAARCT-YNODCEANSA-N
MW250.34 g/mol
LogP2.14
Rot. Bonds3

About (1R)-1-[5-(3-methoxy-3-methylpiperidin-1-yl)-2-pyridinyl]ethanol

(1R)-1-[5-(3-methoxy-3-methylpiperidin-1-yl)-2-pyridinyl]ethanol (PubChem CID 107393509) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is (1R)-1-[5-(3-methoxy-3-methylpiperidin-1-yl)-2-pyridinyl]ethanol.

Molecular Properties

Compound Name(1R)-1-[5-(3-methoxy-3-methylpiperidin-1-yl)-2-pyridinyl]ethanol
PubChem CID107393509
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name(1R)-1-[5-(3-methoxy-3-methylpiperidin-1-yl)-2-pyridinyl]ethanol
SMILESCOC1(C)CCCN(c2ccc([C@@H](C)O)nc2)C1
InChIInChI=1S/C14H22N2O2/c1-11(17)13-6-5-12(9-15-13)16-8-4-7-14(2,10-16)18-3/h5-6,9,11,17H,4,7-8,10H2,1-3H3/t11-,14?/m1/s1
InChIKeyPWVUDOQHBAARCT-YNODCEANSA-N
XLogP2.14
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (1R)-1-[5-(3-methoxy-3-methylpiperidin-1-yl)-2-pyridinyl]ethanol?
The IUPAC name of (1R)-1-[5-(3-methoxy-3-methylpiperidin-1-yl)-2-pyridinyl]ethanol (CID 107393509) is (1R)-1-[5-(3-methoxy-3-methylpiperidin-1-yl)-2-pyridinyl]ethanol.
What is the SMILES notation for (1R)-1-[5-(3-methoxy-3-methylpiperidin-1-yl)-2-pyridinyl]ethanol?
The canonical SMILES for (1R)-1-[5-(3-methoxy-3-methylpiperidin-1-yl)-2-pyridinyl]ethanol is COC1(C)CCCN(c2ccc([C@@H](C)O)nc2)C1.
What is the InChIKey of (1R)-1-[5-(3-methoxy-3-methylpiperidin-1-yl)-2-pyridinyl]ethanol?
The InChIKey is PWVUDOQHBAARCT-YNODCEANSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-11(17)13-6-5-12(9-15-13)16-8-4-7-14(2,10-16)18-3/h5-6,9,11,17H,4,7-8,10H2,1-3H3/t11-,14?/m1/s1.
What are the key properties of (1R)-1-[5-(3-methoxy-3-methylpiperidin-1-yl)-2-pyridinyl]ethanol?
(1R)-1-[5-(3-methoxy-3-methylpiperidin-1-yl)-2-pyridinyl]ethanol has a molecular weight of 250.34 g/mol, XLogP of 2.14, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[5-(3-methoxy-3-methylpiperidin-1-yl)-2-pyridinyl]ethanol is sourced from PubChem (CID 107393509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).