1-(2-cyclobutyl-2-fluoroethyl)cyclopropan-1-amine

C9H16FN — CID 105430744

IUPAC1-(2-cyclobutyl-2-fluoroethyl)cyclopropan-1-amine
SMILESNC1(CC(F)C2CCC2)CC1
InChIInChI=1S/C9H16FN/c10-8(7-2-1-3-7)6-9(11)4-5-9/h7-8H,1-6,11H2
InChIKeyHILZIPSEJQTEFS-UHFFFAOYSA-N
MW157.23 g/mol
LogP2.01
Rot. Bonds3

About 1-(2-cyclobutyl-2-fluoroethyl)cyclopropan-1-amine

1-(2-cyclobutyl-2-fluoroethyl)cyclopropan-1-amine (PubChem CID 105430744) has the molecular formula C9H16FN and a molecular weight of 157.23 g/mol. Its IUPAC name is 1-(2-cyclobutyl-2-fluoroethyl)cyclopropan-1-amine.

Molecular Properties

Compound Name1-(2-cyclobutyl-2-fluoroethyl)cyclopropan-1-amine
PubChem CID105430744
Molecular FormulaC9H16FN
Molecular Weight157.23 g/mol
Exact Mass157.13
IUPAC Name1-(2-cyclobutyl-2-fluoroethyl)cyclopropan-1-amine
SMILESNC1(CC(F)C2CCC2)CC1
InChIInChI=1S/C9H16FN/c10-8(7-2-1-3-7)6-9(11)4-5-9/h7-8H,1-6,11H2
InChIKeyHILZIPSEJQTEFS-UHFFFAOYSA-N
XLogP2.01
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.23
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(2-cyclobutyl-2-fluoroethyl)cyclopropan-1-amine?
The IUPAC name of 1-(2-cyclobutyl-2-fluoroethyl)cyclopropan-1-amine (CID 105430744) is 1-(2-cyclobutyl-2-fluoroethyl)cyclopropan-1-amine.
What is the SMILES notation for 1-(2-cyclobutyl-2-fluoroethyl)cyclopropan-1-amine?
The canonical SMILES for 1-(2-cyclobutyl-2-fluoroethyl)cyclopropan-1-amine is NC1(CC(F)C2CCC2)CC1.
What is the InChIKey of 1-(2-cyclobutyl-2-fluoroethyl)cyclopropan-1-amine?
The InChIKey is HILZIPSEJQTEFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16FN/c10-8(7-2-1-3-7)6-9(11)4-5-9/h7-8H,1-6,11H2.
What are the key properties of 1-(2-cyclobutyl-2-fluoroethyl)cyclopropan-1-amine?
1-(2-cyclobutyl-2-fluoroethyl)cyclopropan-1-amine has a molecular weight of 157.23 g/mol, XLogP of 2.01, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclobutyl-2-fluoroethyl)cyclopropan-1-amine is sourced from PubChem (CID 105430744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).