1-[(4,7-difluoro-2,3-dihydro-1H-inden-2-yl)methyl]piperidin-4-ol

C15H19F2NO — CID 157039249

IUPAC1-[(4,7-difluoro-2,3-dihydro-1H-inden-2-yl)methyl]piperidin-4-ol
SMILESOC1CCN(CC2Cc3c(F)ccc(F)c3C2)CC1
InChIInChI=1S/C15H19F2NO/c16-14-1-2-15(17)13-8-10(7-12(13)14)9-18-5-3-11(19)4-6-18/h1-2,10-11,19H,3-9H2
InChIKeyQXVXXNGXTCAFFK-UHFFFAOYSA-N
MW267.32 g/mol
LogP2.14
Rot. Bonds2

About 1-[(4,7-difluoro-2,3-dihydro-1H-inden-2-yl)methyl]piperidin-4-ol

1-[(4,7-difluoro-2,3-dihydro-1H-inden-2-yl)methyl]piperidin-4-ol (PubChem CID 157039249) has the molecular formula C15H19F2NO and a molecular weight of 267.32 g/mol. Its IUPAC name is 1-[(4,7-difluoro-2,3-dihydro-1H-inden-2-yl)methyl]piperidin-4-ol.

Molecular Properties

Compound Name1-[(4,7-difluoro-2,3-dihydro-1H-inden-2-yl)methyl]piperidin-4-ol
PubChem CID157039249
Molecular FormulaC15H19F2NO
Molecular Weight267.32 g/mol
Exact Mass267.14
IUPAC Name1-[(4,7-difluoro-2,3-dihydro-1H-inden-2-yl)methyl]piperidin-4-ol
SMILESOC1CCN(CC2Cc3c(F)ccc(F)c3C2)CC1
InChIInChI=1S/C15H19F2NO/c16-14-1-2-15(17)13-8-10(7-12(13)14)9-18-5-3-11(19)4-6-18/h1-2,10-11,19H,3-9H2
InChIKeyQXVXXNGXTCAFFK-UHFFFAOYSA-N
XLogP2.14
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.32
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-[(4,7-difluoro-2,3-dihydro-1H-inden-2-yl)methyl]piperidin-4-ol with MolForge

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Related Compounds

1-(cyclopropylmethyl)piperidin-4-ol
CID 21428752
1-[(2,5-difluorophenyl)methyl]piperidin-4-ol
CID 24904993
1-(2,3-dihydronaphthalen-2-ylmethyl)piperidin-4-ol
CID 87603240
1-[(4-chlorophenyl)methyl]piperidin-4-ol
CID 764482
1-[(2-fluorophenyl)methyl]piperidin-4-ol
CID 10242192
1-(cyclohexylmethyl)piperidin-4-ol;trifluoromethanol
CID 157039193
2-(pyrrolidin-1-ylmethyl)-2,3-dihydro-1H-inden-4-ol
CID 105471672
1-[(5-chloro-2,3-dihydro-1-benzofuran-2-yl)methyl]piperidin-4-ol
CID 66361048
1-(2,5-difluorophenyl)piperidin-4-ol
CID 141069702
1-(azetidin-3-ylmethyl)piperidin-4-ol;cyclohexane
CID 157039213
1-[2-(3-chloro-2,6-difluorophenyl)ethyl]piperidin-4-ol
CID 157039084
[4-fluoro-3-[(4-hydroxypiperidin-1-yl)methyl]phenyl]boronic acid
CID 91758879

Frequently Asked Questions

What is the IUPAC name of 1-[(4,7-difluoro-2,3-dihydro-1H-inden-2-yl)methyl]piperidin-4-ol?
The IUPAC name of 1-[(4,7-difluoro-2,3-dihydro-1H-inden-2-yl)methyl]piperidin-4-ol (CID 157039249) is 1-[(4,7-difluoro-2,3-dihydro-1H-inden-2-yl)methyl]piperidin-4-ol.
What is the SMILES notation for 1-[(4,7-difluoro-2,3-dihydro-1H-inden-2-yl)methyl]piperidin-4-ol?
The canonical SMILES for 1-[(4,7-difluoro-2,3-dihydro-1H-inden-2-yl)methyl]piperidin-4-ol is OC1CCN(CC2Cc3c(F)ccc(F)c3C2)CC1.
What is the InChIKey of 1-[(4,7-difluoro-2,3-dihydro-1H-inden-2-yl)methyl]piperidin-4-ol?
The InChIKey is QXVXXNGXTCAFFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19F2NO/c16-14-1-2-15(17)13-8-10(7-12(13)14)9-18-5-3-11(19)4-6-18/h1-2,10-11,19H,3-9H2.
What are the key properties of 1-[(4,7-difluoro-2,3-dihydro-1H-inden-2-yl)methyl]piperidin-4-ol?
1-[(4,7-difluoro-2,3-dihydro-1H-inden-2-yl)methyl]piperidin-4-ol has a molecular weight of 267.32 g/mol, XLogP of 2.14, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4,7-difluoro-2,3-dihydro-1H-inden-2-yl)methyl]piperidin-4-ol is sourced from PubChem (CID 157039249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).