4-cyclobutyl-4-fluoro-5-methoxypentan-1-amine

C10H20FNO — CID 103392583

IUPAC4-cyclobutyl-4-fluoro-5-methoxypentan-1-amine
SMILESCOCC(F)(CCCN)C1CCC1
InChIInChI=1S/C10H20FNO/c1-13-8-10(11,6-3-7-12)9-4-2-5-9/h9H,2-8,12H2,1H3
InChIKeyMFHITZYKRAHDMK-UHFFFAOYSA-N
MW189.27 g/mol
LogP1.88
Rot. Bonds6

About 4-cyclobutyl-4-fluoro-5-methoxypentan-1-amine

4-cyclobutyl-4-fluoro-5-methoxypentan-1-amine (PubChem CID 103392583) has the molecular formula C10H20FNO and a molecular weight of 189.27 g/mol. Its IUPAC name is 4-cyclobutyl-4-fluoro-5-methoxypentan-1-amine.

Molecular Properties

Compound Name4-cyclobutyl-4-fluoro-5-methoxypentan-1-amine
PubChem CID103392583
Molecular FormulaC10H20FNO
Molecular Weight189.27 g/mol
Exact Mass189.15
IUPAC Name4-cyclobutyl-4-fluoro-5-methoxypentan-1-amine
SMILESCOCC(F)(CCCN)C1CCC1
InChIInChI=1S/C10H20FNO/c1-13-8-10(11,6-3-7-12)9-4-2-5-9/h9H,2-8,12H2,1H3
InChIKeyMFHITZYKRAHDMK-UHFFFAOYSA-N
XLogP1.88
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.27
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[2-[3-(2,2,2-Trifluoroethoxy)propyl]cyclobutyl]methanamine
CID 81009629
4-Fluoro-4-(methoxymethyl)-6-methylnonan-1-amine
CID 103392364
4-Fluoro-4-(methoxymethyl)-6-methyloctan-1-amine
CID 103392386
4-Fluoro-4-(methoxymethyl)-7-methyloctan-1-amine
CID 103392394
4-Fluoro-4-(methoxymethyl)tridecan-1-amine
CID 103392396
4-Fluoro-4-(methoxymethyl)dodecan-1-amine
CID 103392406
4-Fluoro-6-methoxy-4-(methoxymethyl)-5-methylhexan-1-amine
CID 103392424
4-Fluoro-4-(methoxymethyl)-6-methylheptan-1-amine
CID 103392443
4-Fluoro-4-(methoxymethyl)undecan-1-amine
CID 103392444
4-Cyclopropyl-4-fluoro-5-methoxypentan-1-amine
CID 103392479
4-Fluoro-7-methoxy-4-(methoxymethyl)-5-methylheptan-1-amine
CID 103392482
4-Fluoro-4-(methoxymethyl)heptan-1-amine
CID 103392513

Frequently Asked Questions

What is the IUPAC name of 4-cyclobutyl-4-fluoro-5-methoxypentan-1-amine?
The IUPAC name of 4-cyclobutyl-4-fluoro-5-methoxypentan-1-amine (CID 103392583) is 4-cyclobutyl-4-fluoro-5-methoxypentan-1-amine.
What is the SMILES notation for 4-cyclobutyl-4-fluoro-5-methoxypentan-1-amine?
The canonical SMILES for 4-cyclobutyl-4-fluoro-5-methoxypentan-1-amine is COCC(F)(CCCN)C1CCC1.
What is the InChIKey of 4-cyclobutyl-4-fluoro-5-methoxypentan-1-amine?
The InChIKey is MFHITZYKRAHDMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20FNO/c1-13-8-10(11,6-3-7-12)9-4-2-5-9/h9H,2-8,12H2,1H3.
What are the key properties of 4-cyclobutyl-4-fluoro-5-methoxypentan-1-amine?
4-cyclobutyl-4-fluoro-5-methoxypentan-1-amine has a molecular weight of 189.27 g/mol, XLogP of 1.88, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclobutyl-4-fluoro-5-methoxypentan-1-amine is sourced from PubChem (CID 103392583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).