4-cyclopropyl-4-fluoro-5-methoxypentan-1-amine

C9H18FNO — CID 103392479

IUPAC4-cyclopropyl-4-fluoro-5-methoxypentan-1-amine
SMILESCOCC(F)(CCCN)C1CC1
InChIInChI=1S/C9H18FNO/c1-12-7-9(10,5-2-6-11)8-3-4-8/h8H,2-7,11H2,1H3
InChIKeyMOYJYOVLQYUENG-UHFFFAOYSA-N
MW175.25 g/mol
LogP1.49
Rot. Bonds6

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

4-cyclopropyl-4-fluoro-5-methoxypentan-1-amine (PubChem CID 103392479) has the molecular formula C9H18FNO and a molecular weight of 175.25 g/mol. Its IUPAC name is 4-cyclopropyl-4-fluoro-5-methoxypentan-1-amine.

Molecular Properties

Compound Name4-cyclopropyl-4-fluoro-5-methoxypentan-1-amine
PubChem CID103392479
Molecular FormulaC9H18FNO
Molecular Weight175.25 g/mol
Exact Mass175.14
IUPAC Name4-cyclopropyl-4-fluoro-5-methoxypentan-1-amine
SMILESCOCC(F)(CCCN)C1CC1
InChIInChI=1S/C9H18FNO/c1-12-7-9(10,5-2-6-11)8-3-4-8/h8H,2-7,11H2,1H3
InChIKeyMOYJYOVLQYUENG-UHFFFAOYSA-N
XLogP1.49
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.25
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(4-ethylcyclohexyl)-4-fluoro-5-methoxypentan-1-amine
CID 103392599
4-(3,5-dimethylcyclohexyl)-4-fluoro-5-methoxypentan-1-amine
CID 103392563
5-amino-2-cyclobutyl-1-methoxypentan-2-ol
CID 103391375
4-[(3,3-difluorocyclohexyl)methyl]-4-fluoro-5-methoxypentan-1-amine
CID 114225527
4,8,8,8-tetrafluoro-4-(methoxymethyl)octan-1-amine
CID 103392538
1-amino-2-cyclopropyl-3-methoxypropan-2-ol
CID 64813573
2-cyclopropyl-2-fluoro-5,5-dimethylhexan-1-amine
CID 112567040
4-fluoro-4-(4-fluorophenyl)-5-methoxypentan-1-amine
CID 103392579
1-tert-butyl-4-[5,5-difluoro-1-methoxy-2-(methoxymethyl)hexan-2-yl]cyclohexane
CID 174162255
3-cyclopropylbutane-1,3-diamine
CID 150088317
4-fluoro-4-(methoxymethyl)-5-methyloctan-1-amine
CID 107889807
4-fluoro-4-(methoxymethyl)non-7-yn-1-amine
CID 103392609

Frequently Asked Questions

What is the IUPAC name of 4-cyclopropyl-4-fluoro-5-methoxypentan-1-amine?
The IUPAC name of 4-cyclopropyl-4-fluoro-5-methoxypentan-1-amine (CID 103392479) is 4-cyclopropyl-4-fluoro-5-methoxypentan-1-amine.
What is the SMILES notation for 4-cyclopropyl-4-fluoro-5-methoxypentan-1-amine?
The canonical SMILES for 4-cyclopropyl-4-fluoro-5-methoxypentan-1-amine is COCC(F)(CCCN)C1CC1.
What is the InChIKey of 4-cyclopropyl-4-fluoro-5-methoxypentan-1-amine?
The InChIKey is MOYJYOVLQYUENG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18FNO/c1-12-7-9(10,5-2-6-11)8-3-4-8/h8H,2-7,11H2,1H3.
What are the key properties of 4-cyclopropyl-4-fluoro-5-methoxypentan-1-amine?
4-cyclopropyl-4-fluoro-5-methoxypentan-1-amine has a molecular weight of 175.25 g/mol, XLogP of 1.49, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopropyl-4-fluoro-5-methoxypentan-1-amine is sourced from PubChem (CID 103392479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).