1-(2,3-dihydro-1H-inden-2-ylmethyl)-2-methylpiperidin-4-ol

C16H23NO — CID 155302659

IUPAC1-(2,3-dihydro-1H-inden-2-ylmethyl)-2-methylpiperidin-4-ol
SMILESCC1CC(O)CCN1CC1Cc2ccccc2C1
InChIInChI=1S/C16H23NO/c1-12-8-16(18)6-7-17(12)11-13-9-14-4-2-3-5-15(14)10-13/h2-5,12-13,16,18H,6-11H2,1H3
InChIKeyJLOIRJXUHJRCCL-UHFFFAOYSA-N
MW245.37 g/mol
LogP2.25
Rot. Bonds2

About 1-(2,3-dihydro-1H-inden-2-ylmethyl)-2-methylpiperidin-4-ol

1-(2,3-dihydro-1H-inden-2-ylmethyl)-2-methylpiperidin-4-ol (PubChem CID 155302659) has the molecular formula C16H23NO and a molecular weight of 245.37 g/mol. Its IUPAC name is 1-(2,3-dihydro-1H-inden-2-ylmethyl)-2-methylpiperidin-4-ol.

Molecular Properties

Compound Name1-(2,3-dihydro-1H-inden-2-ylmethyl)-2-methylpiperidin-4-ol
PubChem CID155302659
Molecular FormulaC16H23NO
Molecular Weight245.37 g/mol
Exact Mass245.18
IUPAC Name1-(2,3-dihydro-1H-inden-2-ylmethyl)-2-methylpiperidin-4-ol
SMILESCC1CC(O)CCN1CC1Cc2ccccc2C1
InChIInChI=1S/C16H23NO/c1-12-8-16(18)6-7-17(12)11-13-9-14-4-2-3-5-15(14)10-13/h2-5,12-13,16,18H,6-11H2,1H3
InChIKeyJLOIRJXUHJRCCL-UHFFFAOYSA-N
XLogP2.25
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.37
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[3-(4-Tert-butylphenyl)-2-methylpropyl]piperidin-4-ol
CID 13607663
1-(2-Phenylpropyl)piperidin-4-ol
CID 2846178
(1R,6R)-6-(4-phenylpiperidin-1-yl)cyclohex-3-en-1-ol
CID 44450421
trans-2-(2,3-dihydro-1''H-spiro[indene-1,4''-piperidin]-1''-yl)cyclohexanol
CID 10334147
US11214540, Example 25
CID 142475217
1-(4-Phenylpiperidin-1-yl)hexan-2-ol
CID 3788937
2-(4-Phenylpiperidin-1-yl)cyclopentan-1-ol
CID 15925798
1-(2-Hydroxy-butyl)-1-methyl-4-phenyl-piperidinium
CID 15925842
1-(3,3-Diphenylpropyl)piperidin-4-ol
CID 58282550
Cyclopentanol, 2-(4-phenyl-1-piperidinyl)-, trans-(+-)-
CID 3086931
1-(2,3-dihydro-1H-inden-2-yl)piperidin-3-ol
CID 13010316
(1-(2,3-dihydro-1H-inden-2-yl)piperidin-3-yl)methanol
CID 24071864

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydro-1H-inden-2-ylmethyl)-2-methylpiperidin-4-ol?
The IUPAC name of 1-(2,3-dihydro-1H-inden-2-ylmethyl)-2-methylpiperidin-4-ol (CID 155302659) is 1-(2,3-dihydro-1H-inden-2-ylmethyl)-2-methylpiperidin-4-ol.
What is the SMILES notation for 1-(2,3-dihydro-1H-inden-2-ylmethyl)-2-methylpiperidin-4-ol?
The canonical SMILES for 1-(2,3-dihydro-1H-inden-2-ylmethyl)-2-methylpiperidin-4-ol is CC1CC(O)CCN1CC1Cc2ccccc2C1.
What is the InChIKey of 1-(2,3-dihydro-1H-inden-2-ylmethyl)-2-methylpiperidin-4-ol?
The InChIKey is JLOIRJXUHJRCCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO/c1-12-8-16(18)6-7-17(12)11-13-9-14-4-2-3-5-15(14)10-13/h2-5,12-13,16,18H,6-11H2,1H3.
What are the key properties of 1-(2,3-dihydro-1H-inden-2-ylmethyl)-2-methylpiperidin-4-ol?
1-(2,3-dihydro-1H-inden-2-ylmethyl)-2-methylpiperidin-4-ol has a molecular weight of 245.37 g/mol, XLogP of 2.25, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydro-1H-inden-2-ylmethyl)-2-methylpiperidin-4-ol is sourced from PubChem (CID 155302659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).