[4-[(1-methylpyrrolidin-3-yl)methyl]pyrrolidin-2-yl]methanol

C11H22N2O — CID 117270406

IUPAC[4-[(1-methylpyrrolidin-3-yl)methyl]pyrrolidin-2-yl]methanol
SMILESCN1CCC(CC2CNC(CO)C2)C1
InChIInChI=1S/C11H22N2O/c1-13-3-2-9(7-13)4-10-5-11(8-14)12-6-10/h9-12,14H,2-8H2,1H3
InChIKeyHXUAKOKSEGAOEH-UHFFFAOYSA-N
MW198.31 g/mol
LogP0.30
Rot. Bonds3

About [4-[(1-methylpyrrolidin-3-yl)methyl]pyrrolidin-2-yl]methanol

[4-[(1-methylpyrrolidin-3-yl)methyl]pyrrolidin-2-yl]methanol (PubChem CID 117270406) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is [4-[(1-methylpyrrolidin-3-yl)methyl]pyrrolidin-2-yl]methanol.

Molecular Properties

Compound Name[4-[(1-methylpyrrolidin-3-yl)methyl]pyrrolidin-2-yl]methanol
PubChem CID117270406
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name[4-[(1-methylpyrrolidin-3-yl)methyl]pyrrolidin-2-yl]methanol
SMILESCN1CCC(CC2CNC(CO)C2)C1
InChIInChI=1S/C11H22N2O/c1-13-3-2-9(7-13)4-10-5-11(8-14)12-6-10/h9-12,14H,2-8H2,1H3
InChIKeyHXUAKOKSEGAOEH-UHFFFAOYSA-N
XLogP0.30
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 50.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[4-[(1,1-dioxothian-4-yl)methyl]pyrrolidin-2-yl]methanol
CID 117270425
3-(cyclopropylmethyl)-1-methylpyrrolidine
CID 127006990
[4-[(1-ethylpyrrolidin-2-yl)methyl]pyrrolidin-2-yl]methanol
CID 117270553
[4-(2,2-dimethylpropyl)pyrrolidin-2-yl]methanol
CID 117270746
[(2S,4R)-4-propylpyrrolidin-2-yl]methanol
CID 89351797
(4-aminopyrrolidin-2-yl)methanol;ethane
CID 178036634
methyl 4-[(1-methylpiperidin-3-yl)methyl]pyrrolidine-2-carboxylate
CID 117270104
methyl 4-[(1-methylpiperidin-4-yl)methyl]pyrrolidine-2-carboxylate
CID 117269936
[4-(1-methylpyrrolidin-2-yl)pyrrolidin-2-yl]methanol
CID 117270490
[4-(piperidin-1-ylmethyl)pyrrolidin-2-yl]methanol
CID 117270876
[2-methyl-4-[(1-methylpiperidin-4-yl)methyl]pyrrolidin-2-yl]methanol
CID 117270438
(3S)-3-(2,2-dimethylpropyl)-1-methylpyrrolidine
CID 131972870

Frequently Asked Questions

What is the IUPAC name of [4-[(1-methylpyrrolidin-3-yl)methyl]pyrrolidin-2-yl]methanol?
The IUPAC name of [4-[(1-methylpyrrolidin-3-yl)methyl]pyrrolidin-2-yl]methanol (CID 117270406) is [4-[(1-methylpyrrolidin-3-yl)methyl]pyrrolidin-2-yl]methanol.
What is the SMILES notation for [4-[(1-methylpyrrolidin-3-yl)methyl]pyrrolidin-2-yl]methanol?
The canonical SMILES for [4-[(1-methylpyrrolidin-3-yl)methyl]pyrrolidin-2-yl]methanol is CN1CCC(CC2CNC(CO)C2)C1.
What is the InChIKey of [4-[(1-methylpyrrolidin-3-yl)methyl]pyrrolidin-2-yl]methanol?
The InChIKey is HXUAKOKSEGAOEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-13-3-2-9(7-13)4-10-5-11(8-14)12-6-10/h9-12,14H,2-8H2,1H3.
What are the key properties of [4-[(1-methylpyrrolidin-3-yl)methyl]pyrrolidin-2-yl]methanol?
[4-[(1-methylpyrrolidin-3-yl)methyl]pyrrolidin-2-yl]methanol has a molecular weight of 198.31 g/mol, XLogP of 0.30, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(1-methylpyrrolidin-3-yl)methyl]pyrrolidin-2-yl]methanol is sourced from PubChem (CID 117270406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).