(3S)-3-fluoro-1-[[1-(methoxymethyl)cyclopropyl]methyl]pyrrolidine

C10H18FNO — CID 167254755

IUPAC(3S)-3-fluoro-1-[[1-(methoxymethyl)cyclopropyl]methyl]pyrrolidine
SMILESCOCC1(CN2CC[C@H](F)C2)CC1
InChIInChI=1S/C10H18FNO/c1-13-8-10(3-4-10)7-12-5-2-9(11)6-12/h9H,2-8H2,1H3/t9-/m0/s1
InChIKeyUVOWWGPBTQZKFN-VIFPVBQESA-N
MW187.26 g/mol
LogP1.46
Rot. Bonds4

About (3S)-3-fluoro-1-[[1-(methoxymethyl)cyclopropyl]methyl]pyrrolidine

(3S)-3-fluoro-1-[[1-(methoxymethyl)cyclopropyl]methyl]pyrrolidine (PubChem CID 167254755) has the molecular formula C10H18FNO and a molecular weight of 187.26 g/mol. Its IUPAC name is (3S)-3-fluoro-1-[[1-(methoxymethyl)cyclopropyl]methyl]pyrrolidine.

Molecular Properties

Compound Name(3S)-3-fluoro-1-[[1-(methoxymethyl)cyclopropyl]methyl]pyrrolidine
PubChem CID167254755
Molecular FormulaC10H18FNO
Molecular Weight187.26 g/mol
Exact Mass187.14
IUPAC Name(3S)-3-fluoro-1-[[1-(methoxymethyl)cyclopropyl]methyl]pyrrolidine
SMILESCOCC1(CN2CC[C@H](F)C2)CC1
InChIInChI=1S/C10H18FNO/c1-13-8-10(3-4-10)7-12-5-2-9(11)6-12/h9H,2-8H2,1H3/t9-/m0/s1
InChIKeyUVOWWGPBTQZKFN-VIFPVBQESA-N
XLogP1.46
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.26
LogP ≤ 51.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3S)-3-fluoro-1-[[1-(methoxymethyl)cyclopropyl]methyl]pyrrolidine?
The IUPAC name of (3S)-3-fluoro-1-[[1-(methoxymethyl)cyclopropyl]methyl]pyrrolidine (CID 167254755) is (3S)-3-fluoro-1-[[1-(methoxymethyl)cyclopropyl]methyl]pyrrolidine.
What is the SMILES notation for (3S)-3-fluoro-1-[[1-(methoxymethyl)cyclopropyl]methyl]pyrrolidine?
The canonical SMILES for (3S)-3-fluoro-1-[[1-(methoxymethyl)cyclopropyl]methyl]pyrrolidine is COCC1(CN2CC[C@H](F)C2)CC1.
What is the InChIKey of (3S)-3-fluoro-1-[[1-(methoxymethyl)cyclopropyl]methyl]pyrrolidine?
The InChIKey is UVOWWGPBTQZKFN-VIFPVBQESA-N. The full InChI is InChI=1S/C10H18FNO/c1-13-8-10(3-4-10)7-12-5-2-9(11)6-12/h9H,2-8H2,1H3/t9-/m0/s1.
What are the key properties of (3S)-3-fluoro-1-[[1-(methoxymethyl)cyclopropyl]methyl]pyrrolidine?
(3S)-3-fluoro-1-[[1-(methoxymethyl)cyclopropyl]methyl]pyrrolidine has a molecular weight of 187.26 g/mol, XLogP of 1.46, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-3-fluoro-1-[[1-(methoxymethyl)cyclopropyl]methyl]pyrrolidine is sourced from PubChem (CID 167254755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).