[3-(dimethylamino)-1-propylpyrrolidin-3-yl]methanol

C10H22N2O — CID 117012362

IUPAC[3-(dimethylamino)-1-propylpyrrolidin-3-yl]methanol
SMILESCCCN1CCC(CO)(N(C)C)C1
InChIInChI=1S/C10H22N2O/c1-4-6-12-7-5-10(8-12,9-13)11(2)3/h13H,4-9H2,1-3H3
InChIKeyGMLGJUIDNXSRGU-UHFFFAOYSA-N
MW186.30 g/mol
LogP0.39
Rot. Bonds4

About [3-(dimethylamino)-1-propylpyrrolidin-3-yl]methanol

[3-(dimethylamino)-1-propylpyrrolidin-3-yl]methanol (PubChem CID 117012362) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is [3-(dimethylamino)-1-propylpyrrolidin-3-yl]methanol.

Molecular Properties

Compound Name[3-(dimethylamino)-1-propylpyrrolidin-3-yl]methanol
PubChem CID117012362
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC Name[3-(dimethylamino)-1-propylpyrrolidin-3-yl]methanol
SMILESCCCN1CCC(CO)(N(C)C)C1
InChIInChI=1S/C10H22N2O/c1-4-6-12-7-5-10(8-12,9-13)11(2)3/h13H,4-9H2,1-3H3
InChIKeyGMLGJUIDNXSRGU-UHFFFAOYSA-N
XLogP0.39
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 50.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(aminomethyl)-N,N-dimethyl-1-propylpyrrolidin-3-amine
CID 117012434
[3-(dimethylamino)-1-(pyridin-4-ylmethyl)pyrrolidin-3-yl]methanol
CID 117012382
[3-(methylamino)-1-propylpyrrolidin-3-yl]methanol
CID 117012274
3-(hydroxymethyl)-1-propylpiperidin-3-ol
CID 130689857
3-(aminomethyl)-N,N-dimethyl-1-(2-morpholin-4-ylethyl)pyrrolidin-3-amine
CID 117012445
(3R)-3-fluoro-3-methyl-1-propylpyrrolidine
CID 177367853
[3-(dimethylamino)-1-(2,6-dimethylphenyl)pyrrolidin-3-yl]methanol
CID 117012396
3-(2-aminoethyl)-1-propylpyrrolidin-3-ol
CID 83914587
[1-(4-chlorophenyl)-3-(dimethylamino)piperidin-3-yl]methanol
CID 117012686
4-methyl-1-propylpiperidine-4-carboxylic acid
CID 23389278
4-ethynyl-1-propylpiperidin-4-ol
CID 64915760
4-ethyl-1-propylpiperidin-4-ol
CID 60895499

Frequently Asked Questions

What is the IUPAC name of [3-(dimethylamino)-1-propylpyrrolidin-3-yl]methanol?
The IUPAC name of [3-(dimethylamino)-1-propylpyrrolidin-3-yl]methanol (CID 117012362) is [3-(dimethylamino)-1-propylpyrrolidin-3-yl]methanol.
What is the SMILES notation for [3-(dimethylamino)-1-propylpyrrolidin-3-yl]methanol?
The canonical SMILES for [3-(dimethylamino)-1-propylpyrrolidin-3-yl]methanol is CCCN1CCC(CO)(N(C)C)C1.
What is the InChIKey of [3-(dimethylamino)-1-propylpyrrolidin-3-yl]methanol?
The InChIKey is GMLGJUIDNXSRGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O/c1-4-6-12-7-5-10(8-12,9-13)11(2)3/h13H,4-9H2,1-3H3.
What are the key properties of [3-(dimethylamino)-1-propylpyrrolidin-3-yl]methanol?
[3-(dimethylamino)-1-propylpyrrolidin-3-yl]methanol has a molecular weight of 186.30 g/mol, XLogP of 0.39, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(dimethylamino)-1-propylpyrrolidin-3-yl]methanol is sourced from PubChem (CID 117012362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).