1-[[(1-pyridin-2-ylpiperidin-4-yl)amino]methyl]-2,3-dihydroinden-1-ol

C20H25N3O — CID 84595397

IUPAC1-[[(1-pyridin-2-ylpiperidin-4-yl)amino]methyl]-2,3-dihydroinden-1-ol
SMILESOC1(CNC2CCN(c3ccccn3)CC2)CCc2ccccc21
InChIInChI=1S/C20H25N3O/c24-20(11-8-16-5-1-2-6-18(16)20)15-22-17-9-13-23(14-10-17)19-7-3-4-12-21-19/h1-7,12,17,22,24H,8-11,13-15H2
InChIKeyKCZSSNKGKAVXOY-UHFFFAOYSA-N
MW323.44 g/mol
LogP2.47
Rot. Bonds4

About 1-[[(1-pyridin-2-ylpiperidin-4-yl)amino]methyl]-2,3-dihydroinden-1-ol

1-[[(1-pyridin-2-ylpiperidin-4-yl)amino]methyl]-2,3-dihydroinden-1-ol (PubChem CID 84595397) has the molecular formula C20H25N3O and a molecular weight of 323.44 g/mol. Its IUPAC name is 1-[[(1-pyridin-2-ylpiperidin-4-yl)amino]methyl]-2,3-dihydroinden-1-ol.

Molecular Properties

Compound Name1-[[(1-pyridin-2-ylpiperidin-4-yl)amino]methyl]-2,3-dihydroinden-1-ol
PubChem CID84595397
Molecular FormulaC20H25N3O
Molecular Weight323.44 g/mol
Exact Mass323.20
IUPAC Name1-[[(1-pyridin-2-ylpiperidin-4-yl)amino]methyl]-2,3-dihydroinden-1-ol
SMILESOC1(CNC2CCN(c3ccccn3)CC2)CCc2ccccc21
InChIInChI=1S/C20H25N3O/c24-20(11-8-16-5-1-2-6-18(16)20)15-22-17-9-13-23(14-10-17)19-7-3-4-12-21-19/h1-7,12,17,22,24H,8-11,13-15H2
InChIKeyKCZSSNKGKAVXOY-UHFFFAOYSA-N
XLogP2.47
TPSA48.39 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.44
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 1-[[(1-pyridin-2-ylpiperidin-4-yl)amino]methyl]-2,3-dihydroinden-1-ol with MolForge

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Related Compounds

(1R)-1-[[[1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-4-yl]amino]methyl]-2,3-dihydroinden-1-ol
CID 124886104
1-[4-[(1-hydroxy-3,4-dihydro-2H-naphthalen-1-yl)methylamino]piperidin-1-yl]ethanone
CID 111110346
N-[(4-ethylphenyl)methyl]-1-pyridin-2-ylpiperidin-4-amine
CID 119126767
N-(2-phenylethyl)-1-pyridin-2-ylpiperidin-4-amine
CID 43675384
1-pyridin-2-yl-N-(2-pyridin-2-ylethyl)piperidin-4-amine
CID 43761318
1,1-difluoro-3-[(1-pyridin-2-ylpiperidin-4-yl)amino]propan-2-ol
CID 103787981
2-[(1-pyridin-2-ylpiperidin-4-yl)amino]ethylurea
CID 83111405
N-(cyclohex-3-en-1-ylmethyl)-1-pyridin-2-ylpiperidin-4-amine
CID 43675354
N-(2-methylsulfanylethyl)-1-pyridin-2-ylpiperidin-4-amine
CID 63983974
N-[2-[(1-pyridin-2-ylpiperidin-4-yl)amino]ethyl]cyclopropanecarboxamide
CID 115706396
N-[(2-aminophenyl)methyl]-1-pyridin-2-ylpiperidin-4-amine
CID 66387456
2-(1-hydroxycyclohexyl)-N-(1-pyridin-2-ylpiperidin-4-yl)acetamide
CID 111331870

Frequently Asked Questions

What is the IUPAC name of 1-[[(1-pyridin-2-ylpiperidin-4-yl)amino]methyl]-2,3-dihydroinden-1-ol?
The IUPAC name of 1-[[(1-pyridin-2-ylpiperidin-4-yl)amino]methyl]-2,3-dihydroinden-1-ol (CID 84595397) is 1-[[(1-pyridin-2-ylpiperidin-4-yl)amino]methyl]-2,3-dihydroinden-1-ol.
What is the SMILES notation for 1-[[(1-pyridin-2-ylpiperidin-4-yl)amino]methyl]-2,3-dihydroinden-1-ol?
The canonical SMILES for 1-[[(1-pyridin-2-ylpiperidin-4-yl)amino]methyl]-2,3-dihydroinden-1-ol is OC1(CNC2CCN(c3ccccn3)CC2)CCc2ccccc21.
What is the InChIKey of 1-[[(1-pyridin-2-ylpiperidin-4-yl)amino]methyl]-2,3-dihydroinden-1-ol?
The InChIKey is KCZSSNKGKAVXOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O/c24-20(11-8-16-5-1-2-6-18(16)20)15-22-17-9-13-23(14-10-17)19-7-3-4-12-21-19/h1-7,12,17,22,24H,8-11,13-15H2.
What are the key properties of 1-[[(1-pyridin-2-ylpiperidin-4-yl)amino]methyl]-2,3-dihydroinden-1-ol?
1-[[(1-pyridin-2-ylpiperidin-4-yl)amino]methyl]-2,3-dihydroinden-1-ol has a molecular weight of 323.44 g/mol, XLogP of 2.47, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[(1-pyridin-2-ylpiperidin-4-yl)amino]methyl]-2,3-dihydroinden-1-ol is sourced from PubChem (CID 84595397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).