[1-[(1-fluorocyclopropyl)methyl]-2-methylpyrrolidin-3-yl]methanol

C10H18FNO — CID 130634879

IUPAC[1-[(1-fluorocyclopropyl)methyl]-2-methylpyrrolidin-3-yl]methanol
SMILESCC1C(CO)CCN1CC1(F)CC1
InChIInChI=1S/C10H18FNO/c1-8-9(6-13)2-5-12(8)7-10(11)3-4-10/h8-9,13H,2-7H2,1H3
InChIKeyCIPQVBNEKCDGBD-UHFFFAOYSA-N
MW187.26 g/mol
LogP1.19
Rot. Bonds3

About [1-[(1-fluorocyclopropyl)methyl]-2-methylpyrrolidin-3-yl]methanol

[1-[(1-fluorocyclopropyl)methyl]-2-methylpyrrolidin-3-yl]methanol (PubChem CID 130634879) has the molecular formula C10H18FNO and a molecular weight of 187.26 g/mol. Its IUPAC name is [1-[(1-fluorocyclopropyl)methyl]-2-methylpyrrolidin-3-yl]methanol.

Molecular Properties

Compound Name[1-[(1-fluorocyclopropyl)methyl]-2-methylpyrrolidin-3-yl]methanol
PubChem CID130634879
Molecular FormulaC10H18FNO
Molecular Weight187.26 g/mol
Exact Mass187.14
IUPAC Name[1-[(1-fluorocyclopropyl)methyl]-2-methylpyrrolidin-3-yl]methanol
SMILESCC1C(CO)CCN1CC1(F)CC1
InChIInChI=1S/C10H18FNO/c1-8-9(6-13)2-5-12(8)7-10(11)3-4-10/h8-9,13H,2-7H2,1H3
InChIKeyCIPQVBNEKCDGBD-UHFFFAOYSA-N
XLogP1.19
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.26
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1-Isopropylpyrrolidin-3-yl)methanol
CID 16641305
(1-Cyclopropylpyrrolidin-3-yl)methanol
CID 24275425
1-[(3S)-1-tert-butylpyrrolidin-3-yl]-2-fluoroethanol
CID 66815390
1-(1-Tert-butylpyrrolidin-3-yl)-2-fluoroethanol
CID 66815505
3-[3-(1-Fluoroethyl)pyrrolidin-1-yl]propan-1-ol
CID 67281088
3-[3-(2-Fluoroethyl)pyrrolidin-1-yl]propan-1-ol
CID 67283084
1-(1-Tert-butylpyrrolidin-3-yl)-2,2-difluoroethanol
CID 118880823
(3-Fluoro-1-propan-2-ylpyrrolidin-3-yl)methanol
CID 131018705
[3-Fluoro-1-(2-methylpropyl)pyrrolidin-3-yl]methanol
CID 131089403
2,2-Difluoro-1-[1-(3-methylpentan-3-yl)pyrrolidin-3-yl]ethanol
CID 132093062
[1-(1-Fluoropropan-2-yl)pyrrolidin-3-yl]methanol
CID 156294522
[1-[[3-(2,2,2-Trifluoroethyl)pyrrolidin-1-yl]methyl]cyclopropyl]methanol
CID 172394833

Frequently Asked Questions

What is the IUPAC name of [1-[(1-fluorocyclopropyl)methyl]-2-methylpyrrolidin-3-yl]methanol?
The IUPAC name of [1-[(1-fluorocyclopropyl)methyl]-2-methylpyrrolidin-3-yl]methanol (CID 130634879) is [1-[(1-fluorocyclopropyl)methyl]-2-methylpyrrolidin-3-yl]methanol.
What is the SMILES notation for [1-[(1-fluorocyclopropyl)methyl]-2-methylpyrrolidin-3-yl]methanol?
The canonical SMILES for [1-[(1-fluorocyclopropyl)methyl]-2-methylpyrrolidin-3-yl]methanol is CC1C(CO)CCN1CC1(F)CC1.
What is the InChIKey of [1-[(1-fluorocyclopropyl)methyl]-2-methylpyrrolidin-3-yl]methanol?
The InChIKey is CIPQVBNEKCDGBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18FNO/c1-8-9(6-13)2-5-12(8)7-10(11)3-4-10/h8-9,13H,2-7H2,1H3.
What are the key properties of [1-[(1-fluorocyclopropyl)methyl]-2-methylpyrrolidin-3-yl]methanol?
[1-[(1-fluorocyclopropyl)methyl]-2-methylpyrrolidin-3-yl]methanol has a molecular weight of 187.26 g/mol, XLogP of 1.19, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(1-fluorocyclopropyl)methyl]-2-methylpyrrolidin-3-yl]methanol is sourced from PubChem (CID 130634879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).