4-[4-(dimethylamino)piperidin-1-yl]pyrrolidin-3-ol

C11H23N3O — CID 63702628

IUPAC4-[4-(dimethylamino)piperidin-1-yl]pyrrolidin-3-ol
SMILESCN(C)C1CCN(C2CNCC2O)CC1
InChIInChI=1S/C11H23N3O/c1-13(2)9-3-5-14(6-4-9)10-7-12-8-11(10)15/h9-12,15H,3-8H2,1-2H3
InChIKeyKRPBQWPNPZYPOK-UHFFFAOYSA-N
MW213.32 g/mol
LogP-0.65
Rot. Bonds2

About 4-[4-(dimethylamino)piperidin-1-yl]pyrrolidin-3-ol

4-[4-(dimethylamino)piperidin-1-yl]pyrrolidin-3-ol (PubChem CID 63702628) has the molecular formula C11H23N3O and a molecular weight of 213.32 g/mol. Its IUPAC name is 4-[4-(dimethylamino)piperidin-1-yl]pyrrolidin-3-ol.

Molecular Properties

Compound Name4-[4-(dimethylamino)piperidin-1-yl]pyrrolidin-3-ol
PubChem CID63702628
Molecular FormulaC11H23N3O
Molecular Weight213.32 g/mol
Exact Mass213.18
IUPAC Name4-[4-(dimethylamino)piperidin-1-yl]pyrrolidin-3-ol
SMILESCN(C)C1CCN(C2CNCC2O)CC1
InChIInChI=1S/C11H23N3O/c1-13(2)9-3-5-14(6-4-9)10-7-12-8-11(10)15/h9-12,15H,3-8H2,1-2H3
InChIKeyKRPBQWPNPZYPOK-UHFFFAOYSA-N
XLogP-0.65
TPSA38.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 5-0.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[4-(dimethylamino)piperidin-1-yl]pyrrolidin-3-ol?
The IUPAC name of 4-[4-(dimethylamino)piperidin-1-yl]pyrrolidin-3-ol (CID 63702628) is 4-[4-(dimethylamino)piperidin-1-yl]pyrrolidin-3-ol.
What is the SMILES notation for 4-[4-(dimethylamino)piperidin-1-yl]pyrrolidin-3-ol?
The canonical SMILES for 4-[4-(dimethylamino)piperidin-1-yl]pyrrolidin-3-ol is CN(C)C1CCN(C2CNCC2O)CC1.
What is the InChIKey of 4-[4-(dimethylamino)piperidin-1-yl]pyrrolidin-3-ol?
The InChIKey is KRPBQWPNPZYPOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O/c1-13(2)9-3-5-14(6-4-9)10-7-12-8-11(10)15/h9-12,15H,3-8H2,1-2H3.
What are the key properties of 4-[4-(dimethylamino)piperidin-1-yl]pyrrolidin-3-ol?
4-[4-(dimethylamino)piperidin-1-yl]pyrrolidin-3-ol has a molecular weight of 213.32 g/mol, XLogP of -0.65, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(dimethylamino)piperidin-1-yl]pyrrolidin-3-ol is sourced from PubChem (CID 63702628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).