4-(2,5-dihydro-1H-pyrrol-2-yl)-1-methylpiperidin-4-ol

C10H18N2O — CID 130510171

IUPAC4-(2,5-dihydro-1H-pyrrol-2-yl)-1-methylpiperidin-4-ol
SMILESCN1CCC(O)(C2C=CCN2)CC1
InChIInChI=1S/C10H18N2O/c1-12-7-4-10(13,5-8-12)9-3-2-6-11-9/h2-3,9,11,13H,4-8H2,1H3
InChIKeyGCVWTILXTABLKK-UHFFFAOYSA-N
MW182.27 g/mol
LogP-0.03
Rot. Bonds1

About 4-(2,5-dihydro-1H-pyrrol-2-yl)-1-methylpiperidin-4-ol

4-(2,5-dihydro-1H-pyrrol-2-yl)-1-methylpiperidin-4-ol (PubChem CID 130510171) has the molecular formula C10H18N2O and a molecular weight of 182.27 g/mol. Its IUPAC name is 4-(2,5-dihydro-1H-pyrrol-2-yl)-1-methylpiperidin-4-ol.

Molecular Properties

Compound Name4-(2,5-dihydro-1H-pyrrol-2-yl)-1-methylpiperidin-4-ol
PubChem CID130510171
Molecular FormulaC10H18N2O
Molecular Weight182.27 g/mol
Exact Mass182.14
IUPAC Name4-(2,5-dihydro-1H-pyrrol-2-yl)-1-methylpiperidin-4-ol
SMILESCN1CCC(O)(C2C=CCN2)CC1
InChIInChI=1S/C10H18N2O/c1-12-7-4-10(13,5-8-12)9-3-2-6-11-9/h2-3,9,11,13H,4-8H2,1H3
InChIKeyGCVWTILXTABLKK-UHFFFAOYSA-N
XLogP-0.03
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.27
LogP ≤ 5-0.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 4-(2,5-dihydro-1H-pyrrol-2-yl)-1-methylpiperidin-4-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(Z)-2-methyl-3-piperidin-1-ylhex-4-en-2-ol
CID 164669056
4-(1,2-Dihydropyridin-2-yl)piperidin-4-ol
CID 69090804
1-Methyl-4-(2-methyl-1,2,3,6-tetrahydropyridin-3-yl)piperidin-4-ol
CID 143016122
4-[5-(1-Aminoethyl)-1,2-dihydropyridin-2-yl]-1-methylpiperidin-4-ol
CID 143709591
4-methylpiperidin-4-ol;(E)-non-4-ene
CID 170590699
1-Propan-2-yl-4-prop-2-enylpiperidin-1-ium-4-ol
CID 7200983
4-{[(1-Methylpiperidin-4-YL)amino]methyl}hepta-1,6-dien-4-OL
CID 50967811
1-(Cyclohex-2-en-1-ylamino)-2-methylbutan-2-ol
CID 107907099
3-[(Cyclohex-2-en-1-ylamino)methyl]pentan-3-ol
CID 107907101
4-[(4-methyl-3,6-dihydro-2H-pyridin-1-yl)methyl]piperidin-4-ol
CID 114460113
3-[(Cyclopent-3-en-1-ylamino)methyl]pentan-3-ol
CID 114493639
2-(2,4-Dimethyl-1,2,3,6-tetrahydropyridin-6-yl)butan-2-ol
CID 129930420

Frequently Asked Questions

What is the IUPAC name of 4-(2,5-dihydro-1H-pyrrol-2-yl)-1-methylpiperidin-4-ol?
The IUPAC name of 4-(2,5-dihydro-1H-pyrrol-2-yl)-1-methylpiperidin-4-ol (CID 130510171) is 4-(2,5-dihydro-1H-pyrrol-2-yl)-1-methylpiperidin-4-ol.
What is the SMILES notation for 4-(2,5-dihydro-1H-pyrrol-2-yl)-1-methylpiperidin-4-ol?
The canonical SMILES for 4-(2,5-dihydro-1H-pyrrol-2-yl)-1-methylpiperidin-4-ol is CN1CCC(O)(C2C=CCN2)CC1.
What is the InChIKey of 4-(2,5-dihydro-1H-pyrrol-2-yl)-1-methylpiperidin-4-ol?
The InChIKey is GCVWTILXTABLKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O/c1-12-7-4-10(13,5-8-12)9-3-2-6-11-9/h2-3,9,11,13H,4-8H2,1H3.
What are the key properties of 4-(2,5-dihydro-1H-pyrrol-2-yl)-1-methylpiperidin-4-ol?
4-(2,5-dihydro-1H-pyrrol-2-yl)-1-methylpiperidin-4-ol has a molecular weight of 182.27 g/mol, XLogP of -0.03, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,5-dihydro-1H-pyrrol-2-yl)-1-methylpiperidin-4-ol is sourced from PubChem (CID 130510171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).