[1-[[1-(hydroxymethyl)cyclopentyl]methyl]pyrrolidin-3-yl]methanol

C12H23NO2 — CID 112629225

IUPAC[1-[[1-(hydroxymethyl)cyclopentyl]methyl]pyrrolidin-3-yl]methanol
SMILESOCC1CCN(CC2(CO)CCCC2)C1
InChIInChI=1S/C12H23NO2/c14-8-11-3-6-13(7-11)9-12(10-15)4-1-2-5-12/h11,14-15H,1-10H2
InChIKeySMHOWTDSIYCPOG-UHFFFAOYSA-N
MW213.32 g/mol
LogP0.85
Rot. Bonds4

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

[1-[[1-(hydroxymethyl)cyclopentyl]methyl]pyrrolidin-3-yl]methanol (PubChem CID 112629225) has the molecular formula C12H23NO2 and a molecular weight of 213.32 g/mol. Its IUPAC name is [1-[[1-(hydroxymethyl)cyclopentyl]methyl]pyrrolidin-3-yl]methanol.

Molecular Properties

Compound Name[1-[[1-(hydroxymethyl)cyclopentyl]methyl]pyrrolidin-3-yl]methanol
PubChem CID112629225
Molecular FormulaC12H23NO2
Molecular Weight213.32 g/mol
Exact Mass213.17
IUPAC Name[1-[[1-(hydroxymethyl)cyclopentyl]methyl]pyrrolidin-3-yl]methanol
SMILESOCC1CCN(CC2(CO)CCCC2)C1
InChIInChI=1S/C12H23NO2/c14-8-11-3-6-13(7-11)9-12(10-15)4-1-2-5-12/h11,14-15H,1-10H2
InChIKeySMHOWTDSIYCPOG-UHFFFAOYSA-N
XLogP0.85
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 50.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[1-[[1-(bromomethyl)cyclopentyl]methyl]pyrrolidin-3-yl]methanol
CID 112628015
[1-[[1-(aminomethyl)cycloheptyl]methyl]pyrrolidin-3-yl]methanol
CID 112629002
[1-[[1-[(propan-2-ylamino)methyl]cyclopentyl]methyl]pyrrolidin-3-yl]methanol
CID 112628956
[1-[[1-(bromomethyl)cyclopropyl]methyl]pyrrolidin-3-yl]methanol
CID 112628030
[1-[[3-(hydroxymethyl)oxolan-3-yl]methyl]piperidin-3-yl]methanol
CID 62270528
[1-[(4-propylpiperidin-1-yl)methyl]cyclopentyl]methanol
CID 55055613
[1-[[1-(dimethylamino)cyclopentyl]methyl]pyrrolidin-3-yl]methanol
CID 83115466
1-[[3-(hydroxymethyl)pyrrolidin-1-yl]methyl]cycloheptane-1-carbaldehyde
CID 112628845
[1-[(3-methoxy-4-methylpiperidin-1-yl)methyl]cycloheptyl]methanol
CID 102967517
[4-[[3-(methoxymethyl)pyrrolidin-1-yl]methyl]oxan-4-yl]methanol
CID 64581388
[1-[[(3R)-3-fluoropyrrolidin-1-yl]methyl]cyclopropyl]methanol
CID 155348589
[1-[[3-methyl-1-[(propan-2-ylamino)methyl]cyclohexyl]methyl]pyrrolidin-3-yl]methanol
CID 115967160

Frequently Asked Questions

What is the IUPAC name of [1-[[1-(hydroxymethyl)cyclopentyl]methyl]pyrrolidin-3-yl]methanol?
The IUPAC name of [1-[[1-(hydroxymethyl)cyclopentyl]methyl]pyrrolidin-3-yl]methanol (CID 112629225) is [1-[[1-(hydroxymethyl)cyclopentyl]methyl]pyrrolidin-3-yl]methanol.
What is the SMILES notation for [1-[[1-(hydroxymethyl)cyclopentyl]methyl]pyrrolidin-3-yl]methanol?
The canonical SMILES for [1-[[1-(hydroxymethyl)cyclopentyl]methyl]pyrrolidin-3-yl]methanol is OCC1CCN(CC2(CO)CCCC2)C1.
What is the InChIKey of [1-[[1-(hydroxymethyl)cyclopentyl]methyl]pyrrolidin-3-yl]methanol?
The InChIKey is SMHOWTDSIYCPOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO2/c14-8-11-3-6-13(7-11)9-12(10-15)4-1-2-5-12/h11,14-15H,1-10H2.
What are the key properties of [1-[[1-(hydroxymethyl)cyclopentyl]methyl]pyrrolidin-3-yl]methanol?
[1-[[1-(hydroxymethyl)cyclopentyl]methyl]pyrrolidin-3-yl]methanol has a molecular weight of 213.32 g/mol, XLogP of 0.85, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[[1-(hydroxymethyl)cyclopentyl]methyl]pyrrolidin-3-yl]methanol is sourced from PubChem (CID 112629225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).