4-methyl-1-(2-methylpropyl)-3-pyrrolidin-1-ylpiperidin-4-ol

C14H28N2O — CID 156602380

IUPAC4-methyl-1-(2-methylpropyl)-3-pyrrolidin-1-ylpiperidin-4-ol
SMILESCC(C)CN1CCC(C)(O)C(N2CCCC2)C1
InChIInChI=1S/C14H28N2O/c1-12(2)10-15-9-6-14(3,17)13(11-15)16-7-4-5-8-16/h12-13,17H,4-11H2,1-3H3
InChIKeyHRYSEPXLPSSPSF-UHFFFAOYSA-N
MW240.39 g/mol
LogP1.56
Rot. Bonds3

About 4-methyl-1-(2-methylpropyl)-3-pyrrolidin-1-ylpiperidin-4-ol

4-methyl-1-(2-methylpropyl)-3-pyrrolidin-1-ylpiperidin-4-ol (PubChem CID 156602380) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 4-methyl-1-(2-methylpropyl)-3-pyrrolidin-1-ylpiperidin-4-ol.

Molecular Properties

Compound Name4-methyl-1-(2-methylpropyl)-3-pyrrolidin-1-ylpiperidin-4-ol
PubChem CID156602380
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name4-methyl-1-(2-methylpropyl)-3-pyrrolidin-1-ylpiperidin-4-ol
SMILESCC(C)CN1CCC(C)(O)C(N2CCCC2)C1
InChIInChI=1S/C14H28N2O/c1-12(2)10-15-9-6-14(3,17)13(11-15)16-7-4-5-8-16/h12-13,17H,4-11H2,1-3H3
InChIKeyHRYSEPXLPSSPSF-UHFFFAOYSA-N
XLogP1.56
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3R,4R)-1-(cyclohexylmethyl)-4-methyl-3-(1-pyrrolidinyl)hexahydro-4-pyridinol
CID 87053309
1-(Cyclohexylmethyl)-4-methyl-3-pyrrolidin-1-ylpiperidin-4-ol
CID 156602379
1-Tert-butyl-4-(pyrrolidin-1-ylmethyl)piperidin-4-ol
CID 58315315
4-[(Dimethylamino)methyl]-1-propan-2-ylpiperidin-4-ol
CID 59363433
1-[(1-Propan-2-ylpiperidin-4-yl)methyl]pyrrolidin-3-ol
CID 59363464
4-[(2-Methylpyrrolidin-1-yl)methyl]piperidin-4-ol
CID 62221148
4-[[(2R)-2-methylpyrrolidin-1-yl]methyl]piperidin-4-ol
CID 68586808
3-[(4-Propan-2-ylpiperazin-1-yl)methyl]pentan-3-ol
CID 109985849
3-[(4-Butan-2-ylpiperazin-1-yl)methyl]pentan-3-ol
CID 113592334
3-Ethyl-1-propan-2-ylpyrrolidin-3-ol
CID 126994805
2-(4-Ethyl-1-methylpiperazin-2-yl)propan-2-ol
CID 156162673
2-[(2R)-1-methyl-4-propan-2-ylpiperazin-2-yl]propan-2-ol
CID 156163271

Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-(2-methylpropyl)-3-pyrrolidin-1-ylpiperidin-4-ol?
The IUPAC name of 4-methyl-1-(2-methylpropyl)-3-pyrrolidin-1-ylpiperidin-4-ol (CID 156602380) is 4-methyl-1-(2-methylpropyl)-3-pyrrolidin-1-ylpiperidin-4-ol.
What is the SMILES notation for 4-methyl-1-(2-methylpropyl)-3-pyrrolidin-1-ylpiperidin-4-ol?
The canonical SMILES for 4-methyl-1-(2-methylpropyl)-3-pyrrolidin-1-ylpiperidin-4-ol is CC(C)CN1CCC(C)(O)C(N2CCCC2)C1.
What is the InChIKey of 4-methyl-1-(2-methylpropyl)-3-pyrrolidin-1-ylpiperidin-4-ol?
The InChIKey is HRYSEPXLPSSPSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-12(2)10-15-9-6-14(3,17)13(11-15)16-7-4-5-8-16/h12-13,17H,4-11H2,1-3H3.
What are the key properties of 4-methyl-1-(2-methylpropyl)-3-pyrrolidin-1-ylpiperidin-4-ol?
4-methyl-1-(2-methylpropyl)-3-pyrrolidin-1-ylpiperidin-4-ol has a molecular weight of 240.39 g/mol, XLogP of 1.56, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-(2-methylpropyl)-3-pyrrolidin-1-ylpiperidin-4-ol is sourced from PubChem (CID 156602380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).