(1,5-dimethylpyrrolidin-3-yl)methanol;ethane

C9H21NO — CID 144977240

IUPAC(1,5-dimethylpyrrolidin-3-yl)methanol;ethane
SMILESCC.CC1CC(CO)CN1C
InChIInChI=1S/C7H15NO.C2H6/c1-6-3-7(5-9)4-8(6)2;1-2/h6-7,9H,3-5H2,1-2H3;1-2H3
InChIKeyVEEYBPYEFDNBRG-UHFFFAOYSA-N
MW159.27 g/mol
LogP1.35
Rot. Bonds1

About (1,5-dimethylpyrrolidin-3-yl)methanol;ethane

(1,5-dimethylpyrrolidin-3-yl)methanol;ethane (PubChem CID 144977240) has the molecular formula C9H21NO and a molecular weight of 159.27 g/mol. Its IUPAC name is (1,5-dimethylpyrrolidin-3-yl)methanol;ethane.

Molecular Properties

Compound Name(1,5-dimethylpyrrolidin-3-yl)methanol;ethane
PubChem CID144977240
Molecular FormulaC9H21NO
Molecular Weight159.27 g/mol
Exact Mass159.16
IUPAC Name(1,5-dimethylpyrrolidin-3-yl)methanol;ethane
SMILESCC.CC1CC(CO)CN1C
InChIInChI=1S/C7H15NO.C2H6/c1-6-3-7(5-9)4-8(6)2;1-2/h6-7,9H,3-5H2,1-2H3;1-2H3
InChIKeyVEEYBPYEFDNBRG-UHFFFAOYSA-N
XLogP1.35
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.27
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1,3,7,9-tetramethylazonan-5-yl)methanol
CID 167231849
ethane;4-(methoxymethyl)-1,2-dimethylpyrrolidine
CID 144977158
(2R)-4-(methoxymethyl)-1,2-dimethylpyrrolidine
CID 67681529
[(3R,5R)-1-tert-butyl-5-methylpyrrolidin-3-yl]methanol
CID 160603058
1-[4-[(1,5-dimethylpyrrolidin-3-yl)methyl]piperazin-1-yl]ethanone;ethane
CID 171817554
[1-(1,5-dimethylpyrrolidin-3-yl)piperidin-3-yl]methanol
CID 104517008
4-heptyl-1,2-dimethylpyrrolidine
CID 177227057
(1-cyclohexyl-5-methylpyrrolidin-3-yl)methanol
CID 172620416
(3S,5S)-1,5-dimethylpyrrolidin-3-ol
CID 59896080
ethane;(2R,5R)-1,2,4,5-tetramethylpiperidine
CID 145040358
ethane;1,2,4,5-tetramethylpiperazine
CID 164865311
2-chloro-N-[(1,5-dimethylpyrrolidin-3-yl)methyl]prop-2-enamide
CID 130943724

Frequently Asked Questions

What is the IUPAC name of (1,5-dimethylpyrrolidin-3-yl)methanol;ethane?
The IUPAC name of (1,5-dimethylpyrrolidin-3-yl)methanol;ethane (CID 144977240) is (1,5-dimethylpyrrolidin-3-yl)methanol;ethane.
What is the SMILES notation for (1,5-dimethylpyrrolidin-3-yl)methanol;ethane?
The canonical SMILES for (1,5-dimethylpyrrolidin-3-yl)methanol;ethane is CC.CC1CC(CO)CN1C.
What is the InChIKey of (1,5-dimethylpyrrolidin-3-yl)methanol;ethane?
The InChIKey is VEEYBPYEFDNBRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO.C2H6/c1-6-3-7(5-9)4-8(6)2;1-2/h6-7,9H,3-5H2,1-2H3;1-2H3.
What are the key properties of (1,5-dimethylpyrrolidin-3-yl)methanol;ethane?
(1,5-dimethylpyrrolidin-3-yl)methanol;ethane has a molecular weight of 159.27 g/mol, XLogP of 1.35, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1,5-dimethylpyrrolidin-3-yl)methanol;ethane is sourced from PubChem (CID 144977240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).