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

C11H22N2O — CID 115103176

IUPAC[2-[(1-methylpyrrolidin-3-yl)methyl]pyrrolidin-2-yl]methanol
SMILESCN1CCC(CC2(CO)CCCN2)C1
InChIInChI=1S/C11H22N2O/c1-13-6-3-10(8-13)7-11(9-14)4-2-5-12-11/h10,12,14H,2-9H2,1H3
InChIKeyOIICGNQFQBJUCS-UHFFFAOYSA-N
MW198.31 g/mol
LogP0.44
Rot. Bonds3

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

[2-[(1-methylpyrrolidin-3-yl)methyl]pyrrolidin-2-yl]methanol (PubChem CID 115103176) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is [2-[(1-methylpyrrolidin-3-yl)methyl]pyrrolidin-2-yl]methanol.

Molecular Properties

Compound Name[2-[(1-methylpyrrolidin-3-yl)methyl]pyrrolidin-2-yl]methanol
PubChem CID115103176
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name[2-[(1-methylpyrrolidin-3-yl)methyl]pyrrolidin-2-yl]methanol
SMILESCN1CCC(CC2(CO)CCCN2)C1
InChIInChI=1S/C11H22N2O/c1-13-6-3-10(8-13)7-11(9-14)4-2-5-12-11/h10,12,14H,2-9H2,1H3
InChIKeyOIICGNQFQBJUCS-UHFFFAOYSA-N
XLogP0.44
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 ≤ 50.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[2-[(1-methylpiperidin-4-yl)methyl]piperidin-2-yl]methanol
CID 115103547
[2-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyrrolidin-2-yl]methanol
CID 115103178
[2-[(1-propan-2-ylpiperidin-4-yl)methyl]pyrrolidin-2-yl]methanol
CID 115103198
[2-(cyclopentylmethyl)pyrrolidin-2-yl]methanol
CID 83080759
[2-(piperidin-3-ylmethyl)pyrrolidin-2-yl]methanol
CID 115103316
methyl 2-[(1-methylpyrrolidin-3-yl)methyl]pyrrolidine-2-carboxylate
CID 115103188
4-[2-(2-ethylpyrrolidin-2-yl)ethyl]-1-methylpiperidine
CID 117271420
1-[(1-methylpyrrolidin-3-yl)methyl]cyclobutan-1-ol
CID 115073598
[2-[(1,1-dioxothian-3-yl)methyl]piperidin-2-yl]methanol
CID 115103670
N-[(2-ethylpyrrolidin-2-yl)methyl]-N-methyl-1-(1-methylpiperidin-4-yl)methanamine
CID 83074027
[1-[(1-methylpiperidin-3-yl)methyl]cyclopropyl]methanol
CID 116928942
1-ethyl-3-[[2-(methoxymethyl)pyrrolidin-2-yl]methyl]piperidine
CID 117271883

Frequently Asked Questions

What is the IUPAC name of [2-[(1-methylpyrrolidin-3-yl)methyl]pyrrolidin-2-yl]methanol?
The IUPAC name of [2-[(1-methylpyrrolidin-3-yl)methyl]pyrrolidin-2-yl]methanol (CID 115103176) is [2-[(1-methylpyrrolidin-3-yl)methyl]pyrrolidin-2-yl]methanol.
What is the SMILES notation for [2-[(1-methylpyrrolidin-3-yl)methyl]pyrrolidin-2-yl]methanol?
The canonical SMILES for [2-[(1-methylpyrrolidin-3-yl)methyl]pyrrolidin-2-yl]methanol is CN1CCC(CC2(CO)CCCN2)C1.
What is the InChIKey of [2-[(1-methylpyrrolidin-3-yl)methyl]pyrrolidin-2-yl]methanol?
The InChIKey is OIICGNQFQBJUCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-13-6-3-10(8-13)7-11(9-14)4-2-5-12-11/h10,12,14H,2-9H2,1H3.
What are the key properties of [2-[(1-methylpyrrolidin-3-yl)methyl]pyrrolidin-2-yl]methanol?
[2-[(1-methylpyrrolidin-3-yl)methyl]pyrrolidin-2-yl]methanol has a molecular weight of 198.31 g/mol, XLogP of 0.44, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(1-methylpyrrolidin-3-yl)methyl]pyrrolidin-2-yl]methanol is sourced from PubChem (CID 115103176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).