N-[(1-fluorocyclobutyl)methyl]-3-methylcyclopentan-1-amine

C11H20FN — CID 130747190

IUPACN-[(1-fluorocyclobutyl)methyl]-3-methylcyclopentan-1-amine
SMILESCC1CCC(NCC2(F)CCC2)C1
InChIInChI=1S/C11H20FN/c1-9-3-4-10(7-9)13-8-11(12)5-2-6-11/h9-10,13H,2-8H2,1H3
InChIKeyLFPYRMNEPVYQGZ-UHFFFAOYSA-N
MW185.29 g/mol
LogP2.66
Rot. Bonds3

About N-[(1-fluorocyclobutyl)methyl]-3-methylcyclopentan-1-amine

N-[(1-fluorocyclobutyl)methyl]-3-methylcyclopentan-1-amine (PubChem CID 130747190) has the molecular formula C11H20FN and a molecular weight of 185.29 g/mol. Its IUPAC name is N-[(1-fluorocyclobutyl)methyl]-3-methylcyclopentan-1-amine.

Molecular Properties

Compound NameN-[(1-fluorocyclobutyl)methyl]-3-methylcyclopentan-1-amine
PubChem CID130747190
Molecular FormulaC11H20FN
Molecular Weight185.29 g/mol
Exact Mass185.16
IUPAC NameN-[(1-fluorocyclobutyl)methyl]-3-methylcyclopentan-1-amine
SMILESCC1CCC(NCC2(F)CCC2)C1
InChIInChI=1S/C11H20FN/c1-9-3-4-10(7-9)13-8-11(12)5-2-6-11/h9-10,13H,2-8H2,1H3
InChIKeyLFPYRMNEPVYQGZ-UHFFFAOYSA-N
XLogP2.66
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.29
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-[(1-fluorocyclobutyl)methyl]-3-methylcyclopentan-1-amine?
The IUPAC name of N-[(1-fluorocyclobutyl)methyl]-3-methylcyclopentan-1-amine (CID 130747190) is N-[(1-fluorocyclobutyl)methyl]-3-methylcyclopentan-1-amine.
What is the SMILES notation for N-[(1-fluorocyclobutyl)methyl]-3-methylcyclopentan-1-amine?
The canonical SMILES for N-[(1-fluorocyclobutyl)methyl]-3-methylcyclopentan-1-amine is CC1CCC(NCC2(F)CCC2)C1.
What is the InChIKey of N-[(1-fluorocyclobutyl)methyl]-3-methylcyclopentan-1-amine?
The InChIKey is LFPYRMNEPVYQGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20FN/c1-9-3-4-10(7-9)13-8-11(12)5-2-6-11/h9-10,13H,2-8H2,1H3.
What are the key properties of N-[(1-fluorocyclobutyl)methyl]-3-methylcyclopentan-1-amine?
N-[(1-fluorocyclobutyl)methyl]-3-methylcyclopentan-1-amine has a molecular weight of 185.29 g/mol, XLogP of 2.66, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-fluorocyclobutyl)methyl]-3-methylcyclopentan-1-amine is sourced from PubChem (CID 130747190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).