4-[(2-methylpyrrolidin-1-yl)methyl]piperidin-4-ol

C11H22N2O — CID 62221148

IUPAC4-[(2-methylpyrrolidin-1-yl)methyl]piperidin-4-ol
SMILESCC1CCCN1CC1(O)CCNCC1
InChIInChI=1S/C11H22N2O/c1-10-3-2-8-13(10)9-11(14)4-6-12-7-5-11/h10,12,14H,2-9H2,1H3
InChIKeyCCKYYYVTDCGKNV-UHFFFAOYSA-N
MW198.31 g/mol
LogP0.59
Rot. Bonds2

About 4-[(2-methylpyrrolidin-1-yl)methyl]piperidin-4-ol

4-[(2-methylpyrrolidin-1-yl)methyl]piperidin-4-ol (PubChem CID 62221148) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is 4-[(2-methylpyrrolidin-1-yl)methyl]piperidin-4-ol.

Molecular Properties

Compound Name4-[(2-methylpyrrolidin-1-yl)methyl]piperidin-4-ol
PubChem CID62221148
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name4-[(2-methylpyrrolidin-1-yl)methyl]piperidin-4-ol
SMILESCC1CCCN1CC1(O)CCNCC1
InChIInChI=1S/C11H22N2O/c1-10-3-2-8-13(10)9-11(14)4-6-12-7-5-11/h10,12,14H,2-9H2,1H3
InChIKeyCCKYYYVTDCGKNV-UHFFFAOYSA-N
XLogP0.59
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 50.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-[(2-methylpyrrolidin-1-yl)methyl]piperidin-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

Frequently Asked Questions

What is the IUPAC name of 4-[(2-methylpyrrolidin-1-yl)methyl]piperidin-4-ol?
The IUPAC name of 4-[(2-methylpyrrolidin-1-yl)methyl]piperidin-4-ol (CID 62221148) is 4-[(2-methylpyrrolidin-1-yl)methyl]piperidin-4-ol.
What is the SMILES notation for 4-[(2-methylpyrrolidin-1-yl)methyl]piperidin-4-ol?
The canonical SMILES for 4-[(2-methylpyrrolidin-1-yl)methyl]piperidin-4-ol is CC1CCCN1CC1(O)CCNCC1.
What is the InChIKey of 4-[(2-methylpyrrolidin-1-yl)methyl]piperidin-4-ol?
The InChIKey is CCKYYYVTDCGKNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-10-3-2-8-13(10)9-11(14)4-6-12-7-5-11/h10,12,14H,2-9H2,1H3.
What are the key properties of 4-[(2-methylpyrrolidin-1-yl)methyl]piperidin-4-ol?
4-[(2-methylpyrrolidin-1-yl)methyl]piperidin-4-ol has a molecular weight of 198.31 g/mol, XLogP of 0.59, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-methylpyrrolidin-1-yl)methyl]piperidin-4-ol is sourced from PubChem (CID 62221148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).