4-[methyl(2-pyrrolidin-1-ylethyl)amino]pyrrolidin-3-ol

C11H23N3O — CID 63702905

IUPAC4-[methyl(2-pyrrolidin-1-ylethyl)amino]pyrrolidin-3-ol
SMILESCN(CCN1CCCC1)C1CNCC1O
InChIInChI=1S/C11H23N3O/c1-13(10-8-12-9-11(10)15)6-7-14-4-2-3-5-14/h10-12,15H,2-9H2,1H3
InChIKeyHQLPNEZPWQUCOI-UHFFFAOYSA-N
MW213.32 g/mol
LogP-0.65
Rot. Bonds4

About 4-[methyl(2-pyrrolidin-1-ylethyl)amino]pyrrolidin-3-ol

4-[methyl(2-pyrrolidin-1-ylethyl)amino]pyrrolidin-3-ol (PubChem CID 63702905) has the molecular formula C11H23N3O and a molecular weight of 213.32 g/mol. Its IUPAC name is 4-[methyl(2-pyrrolidin-1-ylethyl)amino]pyrrolidin-3-ol.

Molecular Properties

Compound Name4-[methyl(2-pyrrolidin-1-ylethyl)amino]pyrrolidin-3-ol
PubChem CID63702905
Molecular FormulaC11H23N3O
Molecular Weight213.32 g/mol
Exact Mass213.18
IUPAC Name4-[methyl(2-pyrrolidin-1-ylethyl)amino]pyrrolidin-3-ol
SMILESCN(CCN1CCCC1)C1CNCC1O
InChIInChI=1S/C11H23N3O/c1-13(10-8-12-9-11(10)15)6-7-14-4-2-3-5-14/h10-12,15H,2-9H2,1H3
InChIKeyHQLPNEZPWQUCOI-UHFFFAOYSA-N
XLogP-0.65
TPSA38.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
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-[methyl(2-pyrrolidin-1-ylethyl)amino]pyrrolidin-3-ol?
The IUPAC name of 4-[methyl(2-pyrrolidin-1-ylethyl)amino]pyrrolidin-3-ol (CID 63702905) is 4-[methyl(2-pyrrolidin-1-ylethyl)amino]pyrrolidin-3-ol.
What is the SMILES notation for 4-[methyl(2-pyrrolidin-1-ylethyl)amino]pyrrolidin-3-ol?
The canonical SMILES for 4-[methyl(2-pyrrolidin-1-ylethyl)amino]pyrrolidin-3-ol is CN(CCN1CCCC1)C1CNCC1O.
What is the InChIKey of 4-[methyl(2-pyrrolidin-1-ylethyl)amino]pyrrolidin-3-ol?
The InChIKey is HQLPNEZPWQUCOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O/c1-13(10-8-12-9-11(10)15)6-7-14-4-2-3-5-14/h10-12,15H,2-9H2,1H3.
What are the key properties of 4-[methyl(2-pyrrolidin-1-ylethyl)amino]pyrrolidin-3-ol?
4-[methyl(2-pyrrolidin-1-ylethyl)amino]pyrrolidin-3-ol has a molecular weight of 213.32 g/mol, XLogP of -0.65, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[methyl(2-pyrrolidin-1-ylethyl)amino]pyrrolidin-3-ol is sourced from PubChem (CID 63702905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).