2,5-dihydro-1H-pyrrol-2-yl(piperidin-2-yl)methanol

C10H18N2O — CID 130510528

IUPAC2,5-dihydro-1H-pyrrol-2-yl(piperidin-2-yl)methanol
SMILESOC(C1C=CCN1)C1CCCCN1
InChIInChI=1S/C10H18N2O/c13-10(9-5-3-7-12-9)8-4-1-2-6-11-8/h3,5,8-13H,1-2,4,6-7H2
InChIKeyIIAKMCYNKVUUSK-UHFFFAOYSA-N
MW182.27 g/mol
LogP0.02
Rot. Bonds2

About 2,5-dihydro-1H-pyrrol-2-yl(piperidin-2-yl)methanol

2,5-dihydro-1H-pyrrol-2-yl(piperidin-2-yl)methanol (PubChem CID 130510528) has the molecular formula C10H18N2O and a molecular weight of 182.27 g/mol. Its IUPAC name is 2,5-dihydro-1H-pyrrol-2-yl(piperidin-2-yl)methanol.

Molecular Properties

Compound Name2,5-dihydro-1H-pyrrol-2-yl(piperidin-2-yl)methanol
PubChem CID130510528
Molecular FormulaC10H18N2O
Molecular Weight182.27 g/mol
Exact Mass182.14
IUPAC Name2,5-dihydro-1H-pyrrol-2-yl(piperidin-2-yl)methanol
SMILESOC(C1C=CCN1)C1CCCCN1
InChIInChI=1S/C10H18N2O/c13-10(9-5-3-7-12-9)8-4-1-2-6-11-8/h3,5,8-13H,1-2,4,6-7H2
InChIKeyIIAKMCYNKVUUSK-UHFFFAOYSA-N
XLogP0.02
TPSA44.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.27
LogP ≤ 50.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(2S,4S)-2-[(E)-pent-3-enyl]piperidin-4-ol
CID 11446566
1-Piperidin-2-ylbut-3-en-1-ol
CID 70541220
1-(ethylamino)-2,3,4,5-tetrahydro-1H-inden-2-ol
CID 123990062
(E)-2-(2-hydroxyethylamino)-1-(5-propylpyrrolidin-2-yl)pent-3-en-1-ol
CID 174315288
(2S,4R,6S)-2-methyl-6-[(E)-non-1-enyl]piperidin-4-ol
CID 10705177
(2S,4S,6S)-2-methyl-6-[(E)-non-1-enyl]piperidin-4-ol
CID 10800039
(1S,2R)-2-(butylamino)cyclohex-3-en-1-ol
CID 11263736
(2R)-1-[(2R)-1,2,3,6-tetrahydropyridin-2-yl]pent-4-en-2-ol
CID 11367215
2-(Butylamino)cyclohex-3-en-1-ol
CID 12406993
(2S,3R,6S)-6-[(1E,3E,5E)-8-hydroxydeca-1,3,5-trienyl]-2-methylpiperidin-3-ol
CID 25140001
(2R,4S)-2-[(E)-pent-3-enyl]piperidin-4-ol
CID 101037225
(1R)-1-[(2S)-2,5-dihydro-1H-pyrrol-2-yl]decan-1-ol
CID 102195816

Frequently Asked Questions

What is the IUPAC name of 2,5-dihydro-1H-pyrrol-2-yl(piperidin-2-yl)methanol?
The IUPAC name of 2,5-dihydro-1H-pyrrol-2-yl(piperidin-2-yl)methanol (CID 130510528) is 2,5-dihydro-1H-pyrrol-2-yl(piperidin-2-yl)methanol.
What is the SMILES notation for 2,5-dihydro-1H-pyrrol-2-yl(piperidin-2-yl)methanol?
The canonical SMILES for 2,5-dihydro-1H-pyrrol-2-yl(piperidin-2-yl)methanol is OC(C1C=CCN1)C1CCCCN1.
What is the InChIKey of 2,5-dihydro-1H-pyrrol-2-yl(piperidin-2-yl)methanol?
The InChIKey is IIAKMCYNKVUUSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O/c13-10(9-5-3-7-12-9)8-4-1-2-6-11-8/h3,5,8-13H,1-2,4,6-7H2.
What are the key properties of 2,5-dihydro-1H-pyrrol-2-yl(piperidin-2-yl)methanol?
2,5-dihydro-1H-pyrrol-2-yl(piperidin-2-yl)methanol has a molecular weight of 182.27 g/mol, XLogP of 0.02, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dihydro-1H-pyrrol-2-yl(piperidin-2-yl)methanol is sourced from PubChem (CID 130510528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).