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

C20H25N3O — CID 75383150

IUPAC1-[[1-(pyridin-2-ylmethyl)piperidin-4-yl]amino]-2,3-dihydro-1H-inden-4-ol
SMILESOc1cccc2c1CCC2NC1CCN(Cc2ccccn2)CC1
InChIInChI=1S/C20H25N3O/c24-20-6-3-5-17-18(20)7-8-19(17)22-15-9-12-23(13-10-15)14-16-4-1-2-11-21-16/h1-6,11,15,19,22,24H,7-10,12-14H2
InChIKeyVWIWOHLYHYZFMD-UHFFFAOYSA-N
MW323.44 g/mol
LogP3.03
Rot. Bonds4

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

1-[[1-(pyridin-2-ylmethyl)piperidin-4-yl]amino]-2,3-dihydro-1H-inden-4-ol (PubChem CID 75383150) has the molecular formula C20H25N3O and a molecular weight of 323.44 g/mol. Its IUPAC name is 1-[[1-(pyridin-2-ylmethyl)piperidin-4-yl]amino]-2,3-dihydro-1H-inden-4-ol.

Molecular Properties

Compound Name1-[[1-(pyridin-2-ylmethyl)piperidin-4-yl]amino]-2,3-dihydro-1H-inden-4-ol
PubChem CID75383150
Molecular FormulaC20H25N3O
Molecular Weight323.44 g/mol
Exact Mass323.20
IUPAC Name1-[[1-(pyridin-2-ylmethyl)piperidin-4-yl]amino]-2,3-dihydro-1H-inden-4-ol
SMILESOc1cccc2c1CCC2NC1CCN(Cc2ccccn2)CC1
InChIInChI=1S/C20H25N3O/c24-20-6-3-5-17-18(20)7-8-19(17)22-15-9-12-23(13-10-15)14-16-4-1-2-11-21-16/h1-6,11,15,19,22,24H,7-10,12-14H2
InChIKeyVWIWOHLYHYZFMD-UHFFFAOYSA-N
XLogP3.03
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 ≤ 53.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 1-[[1-(pyridin-2-ylmethyl)piperidin-4-yl]amino]-2,3-dihydro-1H-inden-4-ol with MolForge

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Related Compounds

N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]cyclopropanecarboxamide
CID 37476276
1-cyclopentyl-3-[1-(pyridin-2-ylmethyl)piperidin-4-yl]thiourea
CID 100572605
N'-[1-(pyridin-2-ylmethyl)piperidin-4-yl]ethane-1,2-diamine
CID 142667116
N-(cyclopropylmethyl)-1-(pyridin-2-ylmethyl)piperidin-4-amine
CID 78921206
[1-(pyridin-2-ylmethyl)piperidin-4-yl]urea;dihydrochloride
CID 174440638
1-[(1,2-dimethylpiperidin-4-yl)amino]-2,3-dihydro-1H-inden-4-ol
CID 81344352
(5R,6S)-6-tert-butyl-5-[[1-(pyridin-2-ylmethyl)piperidin-4-yl]amino]piperidin-2-one
CID 126803078
2-[(4-bromopiperidin-1-yl)methyl]pyridine
CID 80680400
N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]methanesulfonamide
CID 47140421
1-cyclobutyl-2-methyl-3-[1-(pyridin-2-ylmethyl)piperidin-4-yl]guanidine;hydroiodide
CID 119153797
2-[4-[1-(pyridin-2-ylmethyl)piperidin-4-yl]piperazin-1-yl]ethanol
CID 762879
2-[(4-pyridin-4-ylpiperidin-1-yl)methyl]pyridine
CID 16667834

Frequently Asked Questions

What is the IUPAC name of 1-[[1-(pyridin-2-ylmethyl)piperidin-4-yl]amino]-2,3-dihydro-1H-inden-4-ol?
The IUPAC name of 1-[[1-(pyridin-2-ylmethyl)piperidin-4-yl]amino]-2,3-dihydro-1H-inden-4-ol (CID 75383150) is 1-[[1-(pyridin-2-ylmethyl)piperidin-4-yl]amino]-2,3-dihydro-1H-inden-4-ol.
What is the SMILES notation for 1-[[1-(pyridin-2-ylmethyl)piperidin-4-yl]amino]-2,3-dihydro-1H-inden-4-ol?
The canonical SMILES for 1-[[1-(pyridin-2-ylmethyl)piperidin-4-yl]amino]-2,3-dihydro-1H-inden-4-ol is Oc1cccc2c1CCC2NC1CCN(Cc2ccccn2)CC1.
What is the InChIKey of 1-[[1-(pyridin-2-ylmethyl)piperidin-4-yl]amino]-2,3-dihydro-1H-inden-4-ol?
The InChIKey is VWIWOHLYHYZFMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O/c24-20-6-3-5-17-18(20)7-8-19(17)22-15-9-12-23(13-10-15)14-16-4-1-2-11-21-16/h1-6,11,15,19,22,24H,7-10,12-14H2.
What are the key properties of 1-[[1-(pyridin-2-ylmethyl)piperidin-4-yl]amino]-2,3-dihydro-1H-inden-4-ol?
1-[[1-(pyridin-2-ylmethyl)piperidin-4-yl]amino]-2,3-dihydro-1H-inden-4-ol has a molecular weight of 323.44 g/mol, XLogP of 3.03, 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-ylmethyl)piperidin-4-yl]amino]-2,3-dihydro-1H-inden-4-ol is sourced from PubChem (CID 75383150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).