(2-ethyl-4-fluoro-1-methylpyrrolidin-2-yl)methanol

C8H16FNO — CID 177000352

IUPAC(2-ethyl-4-fluoro-1-methylpyrrolidin-2-yl)methanol
SMILESCCC1(CO)CC(F)CN1C
InChIInChI=1S/C8H16FNO/c1-3-8(6-11)4-7(9)5-10(8)2/h7,11H,3-6H2,1-2H3
InChIKeyPCSAOUSGBCQQJU-UHFFFAOYSA-N
MW161.22 g/mol
LogP0.80
Rot. Bonds2

About (2-ethyl-4-fluoro-1-methylpyrrolidin-2-yl)methanol

(2-ethyl-4-fluoro-1-methylpyrrolidin-2-yl)methanol (PubChem CID 177000352) has the molecular formula C8H16FNO and a molecular weight of 161.22 g/mol. Its IUPAC name is (2-ethyl-4-fluoro-1-methylpyrrolidin-2-yl)methanol.

Molecular Properties

Compound Name(2-ethyl-4-fluoro-1-methylpyrrolidin-2-yl)methanol
PubChem CID177000352
Molecular FormulaC8H16FNO
Molecular Weight161.22 g/mol
Exact Mass161.12
IUPAC Name(2-ethyl-4-fluoro-1-methylpyrrolidin-2-yl)methanol
SMILESCCC1(CO)CC(F)CN1C
InChIInChI=1S/C8H16FNO/c1-3-8(6-11)4-7(9)5-10(8)2/h7,11H,3-6H2,1-2H3
InChIKeyPCSAOUSGBCQQJU-UHFFFAOYSA-N
XLogP0.80
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.22
LogP ≤ 50.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (2-ethyl-4-fluoro-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-1-methylpyrrolidin-2-yl)methanol
CID 71757811
(1-Tert-butyl-4-fluoropyrrolidin-2-yl)methanol
CID 77284419
2-(Methoxymethyl)-1-methyl-2-(2,2,2-trifluoroethyl)pyrrolidine
CID 118615691
1-Ethyl-2-(methoxymethyl)-2-(2,2,2-trifluoroethyl)pyrrolidine
CID 118615712
(2-Ethyl-4,4-difluoro-1-methylpyrrolidin-2-yl)methanol
CID 123449239
(4-Fluoro-1-propan-2-ylpyrrolidin-2-yl)methanol
CID 126997673
[(2S,4S)-4-fluoro-1-(2-methylpropyl)pyrrolidin-2-yl]methanol
CID 127004508
[1-(2,2-Difluoroethyl)-2-methylpyrrolidin-2-yl]methanol
CID 130634120
[1-(2-Fluoroethyl)-2-methylpyrrolidin-2-yl]methanol
CID 130644994
[4-Fluoro-1-(2-methylpropyl)pyrrolidin-2-yl]methanol
CID 130709579
[(2S,4S)-4-fluoro-1-propan-2-ylpyrrolidin-2-yl]methanol
CID 130757224
(2-Fluoro-2-methyltetrahydro-1H-pyrrolizin-7a(5H)-yl)methanol
CID 137419734

Frequently Asked Questions

What is the IUPAC name of (2-ethyl-4-fluoro-1-methylpyrrolidin-2-yl)methanol?
The IUPAC name of (2-ethyl-4-fluoro-1-methylpyrrolidin-2-yl)methanol (CID 177000352) is (2-ethyl-4-fluoro-1-methylpyrrolidin-2-yl)methanol.
What is the SMILES notation for (2-ethyl-4-fluoro-1-methylpyrrolidin-2-yl)methanol?
The canonical SMILES for (2-ethyl-4-fluoro-1-methylpyrrolidin-2-yl)methanol is CCC1(CO)CC(F)CN1C.
What is the InChIKey of (2-ethyl-4-fluoro-1-methylpyrrolidin-2-yl)methanol?
The InChIKey is PCSAOUSGBCQQJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16FNO/c1-3-8(6-11)4-7(9)5-10(8)2/h7,11H,3-6H2,1-2H3.
What are the key properties of (2-ethyl-4-fluoro-1-methylpyrrolidin-2-yl)methanol?
(2-ethyl-4-fluoro-1-methylpyrrolidin-2-yl)methanol has a molecular weight of 161.22 g/mol, XLogP of 0.80, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethyl-4-fluoro-1-methylpyrrolidin-2-yl)methanol is sourced from PubChem (CID 177000352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).