1-[(3-fluoro-2-pyridinyl)oxymethyl]cyclopropane-1-carbaldehyde

C10H10FNO2 — CID 121207873

IUPAC1-[(3-fluoro-2-pyridinyl)oxymethyl]cyclopropane-1-carbaldehyde
SMILESO=CC1(COc2ncccc2F)CC1
InChIInChI=1S/C10H10FNO2/c11-8-2-1-5-12-9(8)14-7-10(6-13)3-4-10/h1-2,5-6H,3-4,7H2
InChIKeyZRRHDVPHSBVDMO-UHFFFAOYSA-N
MW195.19 g/mol
LogP1.58
Rot. Bonds4

About 1-[(3-fluoro-2-pyridinyl)oxymethyl]cyclopropane-1-carbaldehyde

1-[(3-fluoro-2-pyridinyl)oxymethyl]cyclopropane-1-carbaldehyde (PubChem CID 121207873) has the molecular formula C10H10FNO2 and a molecular weight of 195.19 g/mol. Its IUPAC name is 1-[(3-fluoro-2-pyridinyl)oxymethyl]cyclopropane-1-carbaldehyde.

Molecular Properties

Compound Name1-[(3-fluoro-2-pyridinyl)oxymethyl]cyclopropane-1-carbaldehyde
PubChem CID121207873
Molecular FormulaC10H10FNO2
Molecular Weight195.19 g/mol
Exact Mass195.07
IUPAC Name1-[(3-fluoro-2-pyridinyl)oxymethyl]cyclopropane-1-carbaldehyde
SMILESO=CC1(COc2ncccc2F)CC1
InChIInChI=1S/C10H10FNO2/c11-8-2-1-5-12-9(8)14-7-10(6-13)3-4-10/h1-2,5-6H,3-4,7H2
InChIKeyZRRHDVPHSBVDMO-UHFFFAOYSA-N
XLogP1.58
TPSA39.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.19
LogP ≤ 51.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

1-[(3-fluoro-2-pyridinyl)oxymethyl]-7-azabicyclo[2.2.1]heptane
CID 156848733
(2S)-2-[(3-fluoro-2-pyridinyl)oxymethyl]-2-methylpyrrolidine-1-carboxylic acid
CID 175419170
2-[(3-fluoro-2-pyridinyl)oxy]acetic acid
CID 66975791
1-(trityloxymethyl)cyclopropane-1-carbaldehyde
CID 59313181
(3-fluoro-2-pyridinyl) acetate
CID 15091012
N-[2-[(3-fluoro-2-pyridinyl)oxy]ethyl]cyclopentanamine
CID 115750537
2-cyclopentyloxy-3-fluoropyridine
CID 126955068
(3-fluoro-2-pyridinyl)oxyboronic acid
CID 142794049
[(3aS,7aR)-3a-[(3-fluoro-2-pyridinyl)oxymethyl]-2,3,4,6,7,7a-hexahydrofuro[3,2-c]pyridin-5-yl]-(1,3-oxazol-4-yl)methanone;2,2,2-trifluoroacetic acid
CID 127022753
1-(pyridin-3-ylmethyl)cyclopropane-1-carbaldehyde
CID 131187567
1-(pyridin-2-ylmethyl)cyclobutane-1-carbaldehyde
CID 130680563
2-[(3-fluoro-2-pyridinyl)oxymethyl]-6-methylpyridine
CID 126955092

Frequently Asked Questions

What is the IUPAC name of 1-[(3-fluoro-2-pyridinyl)oxymethyl]cyclopropane-1-carbaldehyde?
The IUPAC name of 1-[(3-fluoro-2-pyridinyl)oxymethyl]cyclopropane-1-carbaldehyde (CID 121207873) is 1-[(3-fluoro-2-pyridinyl)oxymethyl]cyclopropane-1-carbaldehyde.
What is the SMILES notation for 1-[(3-fluoro-2-pyridinyl)oxymethyl]cyclopropane-1-carbaldehyde?
The canonical SMILES for 1-[(3-fluoro-2-pyridinyl)oxymethyl]cyclopropane-1-carbaldehyde is O=CC1(COc2ncccc2F)CC1.
What is the InChIKey of 1-[(3-fluoro-2-pyridinyl)oxymethyl]cyclopropane-1-carbaldehyde?
The InChIKey is ZRRHDVPHSBVDMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10FNO2/c11-8-2-1-5-12-9(8)14-7-10(6-13)3-4-10/h1-2,5-6H,3-4,7H2.
What are the key properties of 1-[(3-fluoro-2-pyridinyl)oxymethyl]cyclopropane-1-carbaldehyde?
1-[(3-fluoro-2-pyridinyl)oxymethyl]cyclopropane-1-carbaldehyde has a molecular weight of 195.19 g/mol, XLogP of 1.58, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3-fluoro-2-pyridinyl)oxymethyl]cyclopropane-1-carbaldehyde is sourced from PubChem (CID 121207873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).