1-[(1-methylpiperidin-3-yl)amino]-2,3-dihydro-1H-inden-4-ol

C15H22N2O — CID 61210483

IUPAC1-[(1-methylpiperidin-3-yl)amino]-2,3-dihydro-1H-inden-4-ol
SMILESCN1CCCC(NC2CCc3c(O)cccc32)C1
InChIInChI=1S/C15H22N2O/c1-17-9-3-4-11(10-17)16-14-8-7-13-12(14)5-2-6-15(13)18/h2,5-6,11,14,16,18H,3-4,7-10H2,1H3
InChIKeyCSTMDGPGTGIPBM-UHFFFAOYSA-N
MW246.35 g/mol
LogP2.06
Rot. Bonds2

About 1-[(1-methylpiperidin-3-yl)amino]-2,3-dihydro-1H-inden-4-ol

1-[(1-methylpiperidin-3-yl)amino]-2,3-dihydro-1H-inden-4-ol (PubChem CID 61210483) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is 1-[(1-methylpiperidin-3-yl)amino]-2,3-dihydro-1H-inden-4-ol.

Molecular Properties

Compound Name1-[(1-methylpiperidin-3-yl)amino]-2,3-dihydro-1H-inden-4-ol
PubChem CID61210483
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC Name1-[(1-methylpiperidin-3-yl)amino]-2,3-dihydro-1H-inden-4-ol
SMILESCN1CCCC(NC2CCc3c(O)cccc32)C1
InChIInChI=1S/C15H22N2O/c1-17-9-3-4-11(10-17)16-14-8-7-13-12(14)5-2-6-15(13)18/h2,5-6,11,14,16,18H,3-4,7-10H2,1H3
InChIKeyCSTMDGPGTGIPBM-UHFFFAOYSA-N
XLogP2.06
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(1,2-dimethylpiperidin-4-yl)amino]-2,3-dihydro-1H-inden-4-ol
CID 81344352
1-methyl-N-(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)piperidin-3-amine
CID 81327342
1-[(2-methylcyclopropyl)amino]-2,3-dihydro-1H-inden-4-ol
CID 62397315
1-methyl-N-(4,5,6,7-tetrahydro-1-benzothiophen-4-yl)piperidin-3-amine
CID 62841966
1-[[1-(pyridin-2-ylmethyl)piperidin-4-yl]amino]-2,3-dihydro-1H-inden-4-ol
CID 75383150
1-[(2,2-diethyloxan-4-yl)amino]-2,3-dihydro-1H-inden-4-ol
CID 83035861
1-[(2,3-dimethylcyclopentyl)amino]-2,3-dihydro-1H-inden-4-ol
CID 64908870
1-(1-cyclobutylethylamino)-2,3-dihydro-1H-inden-4-ol
CID 115717656
4-[(4-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]pyrrolidin-2-one
CID 106181808
1-(3-methylpiperidin-1-yl)-2,3-dihydro-1H-inden-4-ol
CID 82974804
1-[[(1S)-1-cyclohexylethyl]amino]-2,3-dihydro-1H-inden-4-ol
CID 81384182
N-cyclooctyl-4-fluoro-2,3-dihydro-1H-inden-1-amine
CID 83065945

Frequently Asked Questions

What is the IUPAC name of 1-[(1-methylpiperidin-3-yl)amino]-2,3-dihydro-1H-inden-4-ol?
The IUPAC name of 1-[(1-methylpiperidin-3-yl)amino]-2,3-dihydro-1H-inden-4-ol (CID 61210483) is 1-[(1-methylpiperidin-3-yl)amino]-2,3-dihydro-1H-inden-4-ol.
What is the SMILES notation for 1-[(1-methylpiperidin-3-yl)amino]-2,3-dihydro-1H-inden-4-ol?
The canonical SMILES for 1-[(1-methylpiperidin-3-yl)amino]-2,3-dihydro-1H-inden-4-ol is CN1CCCC(NC2CCc3c(O)cccc32)C1.
What is the InChIKey of 1-[(1-methylpiperidin-3-yl)amino]-2,3-dihydro-1H-inden-4-ol?
The InChIKey is CSTMDGPGTGIPBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-17-9-3-4-11(10-17)16-14-8-7-13-12(14)5-2-6-15(13)18/h2,5-6,11,14,16,18H,3-4,7-10H2,1H3.
What are the key properties of 1-[(1-methylpiperidin-3-yl)amino]-2,3-dihydro-1H-inden-4-ol?
1-[(1-methylpiperidin-3-yl)amino]-2,3-dihydro-1H-inden-4-ol has a molecular weight of 246.35 g/mol, XLogP of 2.06, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1-methylpiperidin-3-yl)amino]-2,3-dihydro-1H-inden-4-ol is sourced from PubChem (CID 61210483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).