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

C13H26N2O — CID 83115466

IUPAC[1-[[1-(dimethylamino)cyclopentyl]methyl]pyrrolidin-3-yl]methanol
SMILESCN(C)C1(CN2CCC(CO)C2)CCCC1
InChIInChI=1S/C13H26N2O/c1-14(2)13(6-3-4-7-13)11-15-8-5-12(9-15)10-16/h12,16H,3-11H2,1-2H3
InChIKeyRNVYVIUVOXZQJU-UHFFFAOYSA-N
MW226.36 g/mol
LogP1.17
Rot. Bonds4

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

[1-[[1-(dimethylamino)cyclopentyl]methyl]pyrrolidin-3-yl]methanol (PubChem CID 83115466) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is [1-[[1-(dimethylamino)cyclopentyl]methyl]pyrrolidin-3-yl]methanol.

Molecular Properties

Compound Name[1-[[1-(dimethylamino)cyclopentyl]methyl]pyrrolidin-3-yl]methanol
PubChem CID83115466
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name[1-[[1-(dimethylamino)cyclopentyl]methyl]pyrrolidin-3-yl]methanol
SMILESCN(C)C1(CN2CCC(CO)C2)CCCC1
InChIInChI=1S/C13H26N2O/c1-14(2)13(6-3-4-7-13)11-15-8-5-12(9-15)10-16/h12,16H,3-11H2,1-2H3
InChIKeyRNVYVIUVOXZQJU-UHFFFAOYSA-N
XLogP1.17
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [1-[[1-(dimethylamino)cyclopentyl]methyl]pyrrolidin-3-yl]methanol?
The IUPAC name of [1-[[1-(dimethylamino)cyclopentyl]methyl]pyrrolidin-3-yl]methanol (CID 83115466) is [1-[[1-(dimethylamino)cyclopentyl]methyl]pyrrolidin-3-yl]methanol.
What is the SMILES notation for [1-[[1-(dimethylamino)cyclopentyl]methyl]pyrrolidin-3-yl]methanol?
The canonical SMILES for [1-[[1-(dimethylamino)cyclopentyl]methyl]pyrrolidin-3-yl]methanol is CN(C)C1(CN2CCC(CO)C2)CCCC1.
What is the InChIKey of [1-[[1-(dimethylamino)cyclopentyl]methyl]pyrrolidin-3-yl]methanol?
The InChIKey is RNVYVIUVOXZQJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-14(2)13(6-3-4-7-13)11-15-8-5-12(9-15)10-16/h12,16H,3-11H2,1-2H3.
What are the key properties of [1-[[1-(dimethylamino)cyclopentyl]methyl]pyrrolidin-3-yl]methanol?
[1-[[1-(dimethylamino)cyclopentyl]methyl]pyrrolidin-3-yl]methanol has a molecular weight of 226.36 g/mol, XLogP of 1.17, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[[1-(dimethylamino)cyclopentyl]methyl]pyrrolidin-3-yl]methanol is sourced from PubChem (CID 83115466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).