ethane;(2-ethyl-1-methylpyrrolidin-2-yl)methanol

C10H23NO — CID 170726282

IUPACethane;(2-ethyl-1-methylpyrrolidin-2-yl)methanol
SMILESCC.CCC1(CO)CCCN1C
InChIInChI=1S/C8H17NO.C2H6/c1-3-8(7-10)5-4-6-9(8)2;1-2/h10H,3-7H2,1-2H3;1-2H3
InChIKeyIXBVBIIDWNWGMQ-UHFFFAOYSA-N
MW173.30 g/mol
LogP1.88
Rot. Bonds2

About ethane;(2-ethyl-1-methylpyrrolidin-2-yl)methanol

ethane;(2-ethyl-1-methylpyrrolidin-2-yl)methanol (PubChem CID 170726282) has the molecular formula C10H23NO and a molecular weight of 173.30 g/mol. Its IUPAC name is ethane;(2-ethyl-1-methylpyrrolidin-2-yl)methanol.

Molecular Properties

Compound Nameethane;(2-ethyl-1-methylpyrrolidin-2-yl)methanol
PubChem CID170726282
Molecular FormulaC10H23NO
Molecular Weight173.30 g/mol
Exact Mass173.18
IUPAC Nameethane;(2-ethyl-1-methylpyrrolidin-2-yl)methanol
SMILESCC.CCC1(CO)CCCN1C
InChIInChI=1S/C8H17NO.C2H6/c1-3-8(7-10)5-4-6-9(8)2;1-2/h10H,3-7H2,1-2H3;1-2H3
InChIKeyIXBVBIIDWNWGMQ-UHFFFAOYSA-N
XLogP1.88
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.30
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze ethane;(2-ethyl-1-methylpyrrolidin-2-yl)methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-ethyl-2-(methoxymethyl)-1-methylpyrrolidine
CID 118615709
[1-methyl-2-(propan-2-yloxymethyl)pyrrolidin-2-yl]methanol
CID 169202555
CID 101274523
CID 101274523
2-ethyl-1-methyl-2-(propan-2-yloxymethyl)pyrrolidine
CID 176568736
[(2R)-1,2-dimethylpyrrolidin-2-yl]methanol
CID 141207857
[1-methyl-2-(undecan-4-yloxymethyl)pyrrolidin-2-yl]methanol
CID 175617410
acetylene;[(2R)-1,2-dimethylpyrrolidin-2-yl]methanol
CID 168910228
[2-ethyl-1-[(3-methyltriazol-4-yl)methyl]pyrrolidin-2-yl]methanol
CID 154735455
ethane;[(2S,4R)-2-ethyl-4-fluoro-1-methylpyrrolidin-2-yl]methanol
CID 177009844
(2S)-2-(aminomethyl)-2-ethylpyrrolidine-1-carboxylic acid
CID 134539674
1-(2,2-diethylpyrrolidin-1-yl)ethanone
CID 45086484
[1-ethyl-2-(methoxymethyl)pyrrolidin-2-yl]methanol
CID 178025397

Frequently Asked Questions

What is the IUPAC name of ethane;(2-ethyl-1-methylpyrrolidin-2-yl)methanol?
The IUPAC name of ethane;(2-ethyl-1-methylpyrrolidin-2-yl)methanol (CID 170726282) is ethane;(2-ethyl-1-methylpyrrolidin-2-yl)methanol.
What is the SMILES notation for ethane;(2-ethyl-1-methylpyrrolidin-2-yl)methanol?
The canonical SMILES for ethane;(2-ethyl-1-methylpyrrolidin-2-yl)methanol is CC.CCC1(CO)CCCN1C.
What is the InChIKey of ethane;(2-ethyl-1-methylpyrrolidin-2-yl)methanol?
The InChIKey is IXBVBIIDWNWGMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO.C2H6/c1-3-8(7-10)5-4-6-9(8)2;1-2/h10H,3-7H2,1-2H3;1-2H3.
What are the key properties of ethane;(2-ethyl-1-methylpyrrolidin-2-yl)methanol?
ethane;(2-ethyl-1-methylpyrrolidin-2-yl)methanol has a molecular weight of 173.30 g/mol, XLogP of 1.88, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;(2-ethyl-1-methylpyrrolidin-2-yl)methanol is sourced from PubChem (CID 170726282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).