[1-[(1-methylpyrrol-3-yl)methyl]pyrrolidin-3-yl]methanol

C11H18N2O — CID 115882586

IUPAC[1-[(1-methylpyrrol-3-yl)methyl]pyrrolidin-3-yl]methanol
SMILESCn1ccc(CN2CCC(CO)C2)c1
InChIInChI=1S/C11H18N2O/c1-12-4-2-10(6-12)7-13-5-3-11(8-13)9-14/h2,4,6,11,14H,3,5,7-9H2,1H3
InChIKeyJIGKRKDGTNQIRT-UHFFFAOYSA-N
MW194.28 g/mol
LogP0.84
Rot. Bonds3

About [1-[(1-methylpyrrol-3-yl)methyl]pyrrolidin-3-yl]methanol

[1-[(1-methylpyrrol-3-yl)methyl]pyrrolidin-3-yl]methanol (PubChem CID 115882586) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is [1-[(1-methylpyrrol-3-yl)methyl]pyrrolidin-3-yl]methanol.

Molecular Properties

Compound Name[1-[(1-methylpyrrol-3-yl)methyl]pyrrolidin-3-yl]methanol
PubChem CID115882586
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC Name[1-[(1-methylpyrrol-3-yl)methyl]pyrrolidin-3-yl]methanol
SMILESCn1ccc(CN2CCC(CO)C2)c1
InChIInChI=1S/C11H18N2O/c1-12-4-2-10(6-12)7-13-5-3-11(8-13)9-14/h2,4,6,11,14H,3,5,7-9H2,1H3
InChIKeyJIGKRKDGTNQIRT-UHFFFAOYSA-N
XLogP0.84
TPSA28.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [1-[(1-methylpyrrol-3-yl)methyl]pyrrolidin-3-yl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(1-benzylpyrrolidin-3-yl)methanol;hydrochloride
CID 75485238
[(3S)-1-[(3,4-dichlorophenyl)methyl]pyrrolidin-3-yl]methanol
CID 129367742
1-[(1-methylpyrrol-3-yl)methyl]piperidine-4-carboxylic acid
CID 82473036
[(3R)-1-(thiophen-3-ylmethyl)pyrrolidin-3-yl]methanol
CID 129367813
N-[[(3S)-1-[(3-methylphenyl)methyl]pyrrolidin-3-yl]methyl]-2-(1-methylpyrrol-3-yl)acetamide
CID 95204337
[(3S)-1-[(5-bromofuran-2-yl)methyl]pyrrolidin-3-yl]methanol
CID 94407935
[(3R)-1-[(2-propan-2-ylpyrimidin-5-yl)methyl]pyrrolidin-3-yl]methanol
CID 92581382
[1-[(6-bromo-3-pyridinyl)methyl]pyrrolidin-3-yl]methanol
CID 71650079
2-[4-[[3-(hydroxymethyl)pyrrolidin-1-yl]methyl]phenyl]acetohydrazide
CID 105352065
4-[[3-(hydroxymethyl)pyrrolidin-1-yl]methyl]benzenecarboximidamide
CID 112625797
[(3R)-1-[(2-bromo-4-pyridinyl)methyl]pyrrolidin-3-yl]methanol
CID 97169730
3-[[(3S)-3-(hydroxymethyl)pyrrolidin-1-yl]methyl]benzonitrile
CID 129367782

Frequently Asked Questions

What is the IUPAC name of [1-[(1-methylpyrrol-3-yl)methyl]pyrrolidin-3-yl]methanol?
The IUPAC name of [1-[(1-methylpyrrol-3-yl)methyl]pyrrolidin-3-yl]methanol (CID 115882586) is [1-[(1-methylpyrrol-3-yl)methyl]pyrrolidin-3-yl]methanol.
What is the SMILES notation for [1-[(1-methylpyrrol-3-yl)methyl]pyrrolidin-3-yl]methanol?
The canonical SMILES for [1-[(1-methylpyrrol-3-yl)methyl]pyrrolidin-3-yl]methanol is Cn1ccc(CN2CCC(CO)C2)c1.
What is the InChIKey of [1-[(1-methylpyrrol-3-yl)methyl]pyrrolidin-3-yl]methanol?
The InChIKey is JIGKRKDGTNQIRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c1-12-4-2-10(6-12)7-13-5-3-11(8-13)9-14/h2,4,6,11,14H,3,5,7-9H2,1H3.
What are the key properties of [1-[(1-methylpyrrol-3-yl)methyl]pyrrolidin-3-yl]methanol?
[1-[(1-methylpyrrol-3-yl)methyl]pyrrolidin-3-yl]methanol has a molecular weight of 194.28 g/mol, XLogP of 0.84, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(1-methylpyrrol-3-yl)methyl]pyrrolidin-3-yl]methanol is sourced from PubChem (CID 115882586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).