(2-fluorocuban-1-yl)methanamine

C9H10FN — CID 164889507

IUPAC(2-fluorocuban-1-yl)methanamine
SMILESNCC12C3C4C5C3C1(F)C5C42
InChIInChI=1S/C9H10FN/c10-9-6-3-2-4(6)8(9,1-11)5(2)7(3)9/h2-7H,1,11H2
InChIKeyAJZOCMZMMPLNHI-UHFFFAOYSA-N
MW151.18 g/mol
LogP0.41
Rot. Bonds1

About (2-fluorocuban-1-yl)methanamine

(2-fluorocuban-1-yl)methanamine (PubChem CID 164889507) has the molecular formula C9H10FN and a molecular weight of 151.18 g/mol. Its IUPAC name is (2-fluorocuban-1-yl)methanamine.

Molecular Properties

Compound Name(2-fluorocuban-1-yl)methanamine
PubChem CID164889507
Molecular FormulaC9H10FN
Molecular Weight151.18 g/mol
Exact Mass151.08
IUPAC Name(2-fluorocuban-1-yl)methanamine
SMILESNCC12C3C4C5C3C1(F)C5C42
InChIInChI=1S/C9H10FN/c10-9-6-3-2-4(6)8(9,1-11)5(2)7(3)9/h2-7H,1,11H2
InChIKeyAJZOCMZMMPLNHI-UHFFFAOYSA-N
XLogP0.41
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.18
LogP ≤ 50.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

Cuban-1-ylmethanamine
CID 276346
(Cuban-1-yl)methanamine hydrochloride
CID 85716070
C-(6-Cyclopropyl-cuban-3-yl)-methylamine
CID 10261574
(8-Fluorocuban-1-yl)methanamine
CID 124286323
(1-Cyclobutyl-3-fluoro-3-methylcyclobutyl)methanamine
CID 115013909
1-{3,3-Difluoro-[1,1'-bi(cyclobutane)]-1-yl}methanamine
CID 115014470
2-Fluoro-3-spiro[3.3]heptan-2-ylpropan-1-amine
CID 122240285
(2R)-2-fluoro-3-spiro[3.3]heptan-2-ylpropan-1-amine
CID 129563134
(2S)-2-fluoro-3-spiro[3.3]heptan-2-ylpropan-1-amine
CID 129563135
1-[3-(4-Fluorobutyl)bicyclo[1.1.1]pentan-1-yl]methanamine
CID 137944034
1-[3-(5-Fluoropentyl)bicyclo[1.1.1]pentan-1-yl]methanamine
CID 137945701
(1S)-1-(cuban-1-yl)ethan-1-amine
CID 146155306

Frequently Asked Questions

What is the IUPAC name of (2-fluorocuban-1-yl)methanamine?
The IUPAC name of (2-fluorocuban-1-yl)methanamine (CID 164889507) is (2-fluorocuban-1-yl)methanamine.
What is the SMILES notation for (2-fluorocuban-1-yl)methanamine?
The canonical SMILES for (2-fluorocuban-1-yl)methanamine is NCC12C3C4C5C3C1(F)C5C42.
What is the InChIKey of (2-fluorocuban-1-yl)methanamine?
The InChIKey is AJZOCMZMMPLNHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10FN/c10-9-6-3-2-4(6)8(9,1-11)5(2)7(3)9/h2-7H,1,11H2.
What are the key properties of (2-fluorocuban-1-yl)methanamine?
(2-fluorocuban-1-yl)methanamine has a molecular weight of 151.18 g/mol, XLogP of 0.41, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-fluorocuban-1-yl)methanamine is sourced from PubChem (CID 164889507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).