1-(1,2-dihydropyridin-6-yl)-1-piperidin-2-ylpropan-1-ol

C13H22N2O — CID 5251420

IUPAC1-(1,2-dihydropyridin-6-yl)-1-piperidin-2-ylpropan-1-ol
SMILESCCC(O)(C1=CC=CCN1)C1CCCCN1
InChIInChI=1S/C13H22N2O/c1-2-13(16,11-7-3-5-9-14-11)12-8-4-6-10-15-12/h3,5,7,12,14-16H,2,4,6,8-10H2,1H3
InChIKeyALMPLRHTUSNPEJ-UHFFFAOYSA-N
MW222.33 g/mol
LogP1.31
Rot. Bonds3

About 1-(1,2-dihydropyridin-6-yl)-1-piperidin-2-ylpropan-1-ol

1-(1,2-dihydropyridin-6-yl)-1-piperidin-2-ylpropan-1-ol (PubChem CID 5251420) has the molecular formula C13H22N2O and a molecular weight of 222.33 g/mol. Its IUPAC name is 1-(1,2-dihydropyridin-6-yl)-1-piperidin-2-ylpropan-1-ol.

Molecular Properties

Compound Name1-(1,2-dihydropyridin-6-yl)-1-piperidin-2-ylpropan-1-ol
PubChem CID5251420
Molecular FormulaC13H22N2O
Molecular Weight222.33 g/mol
Exact Mass222.17
IUPAC Name1-(1,2-dihydropyridin-6-yl)-1-piperidin-2-ylpropan-1-ol
SMILESCCC(O)(C1=CC=CCN1)C1CCCCN1
InChIInChI=1S/C13H22N2O/c1-2-13(16,11-7-3-5-9-14-11)12-8-4-6-10-15-12/h3,5,7,12,14-16H,2,4,6,8-10H2,1H3
InChIKeyALMPLRHTUSNPEJ-UHFFFAOYSA-N
XLogP1.31
TPSA44.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.33
LogP ≤ 51.31
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

1-phenyl-1-[(2R)-pyrrolidin-2-yl]propan-1-ol
CID 155010547
(1S)-1-phenyl-1-[(2R)-pyrrolidin-2-yl]propan-1-ol
CID 138485227
2-(2-methylbutan-2-yl)piperidine
CID 118553273
6-tert-butyl-1,2-dihydropyridine
CID 19606121
2-(2-methylbutan-2-yl)azepane
CID 62677449
2,6-bis[methoxy-di(piperidin-2-yl)methyl]-1,2-dihydropyridine
CID 5232947
4-(1-hydroxy-1-piperidin-2-ylethyl)phenol
CID 83075523
N-[2-(1,2-dihydropyridin-6-ylmethylamino)ethyl]-N'-(piperidin-2-ylmethyl)ethane-1,2-diamine
CID 6396326
3-[(2S)-azetidin-2-yl]pentan-3-ol
CID 20741953
2-[(2R)-pyrrolidin-2-yl]propan-2-ol
CID 12732175
2-(azepan-2-yl)-1-(2-fluorophenyl)propan-2-ol
CID 114832814
6-[2-(4-methylcyclohexyl)-3-piperidin-2-ylpropyl]-1,2-dihydropyridine
CID 5247287

Frequently Asked Questions

What is the IUPAC name of 1-(1,2-dihydropyridin-6-yl)-1-piperidin-2-ylpropan-1-ol?
The IUPAC name of 1-(1,2-dihydropyridin-6-yl)-1-piperidin-2-ylpropan-1-ol (CID 5251420) is 1-(1,2-dihydropyridin-6-yl)-1-piperidin-2-ylpropan-1-ol.
What is the SMILES notation for 1-(1,2-dihydropyridin-6-yl)-1-piperidin-2-ylpropan-1-ol?
The canonical SMILES for 1-(1,2-dihydropyridin-6-yl)-1-piperidin-2-ylpropan-1-ol is CCC(O)(C1=CC=CCN1)C1CCCCN1.
What is the InChIKey of 1-(1,2-dihydropyridin-6-yl)-1-piperidin-2-ylpropan-1-ol?
The InChIKey is ALMPLRHTUSNPEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O/c1-2-13(16,11-7-3-5-9-14-11)12-8-4-6-10-15-12/h3,5,7,12,14-16H,2,4,6,8-10H2,1H3.
What are the key properties of 1-(1,2-dihydropyridin-6-yl)-1-piperidin-2-ylpropan-1-ol?
1-(1,2-dihydropyridin-6-yl)-1-piperidin-2-ylpropan-1-ol has a molecular weight of 222.33 g/mol, XLogP of 1.31, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,2-dihydropyridin-6-yl)-1-piperidin-2-ylpropan-1-ol is sourced from PubChem (CID 5251420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).