cis-(1S,2R)-2-fluoro-N-(3-methylcyclobutyl)cyclopentan-1-amine

C10H18FN — CID 130921555

IUPACcis-(1S,2R)-2-fluoro-N-(3-methylcyclobutyl)cyclopentan-1-amine
SMILESCC1CC(N[C@H]2CCC[C@H]2F)C1
InChIInChI=1S/C10H18FN/c1-7-5-8(6-7)12-10-4-2-3-9(10)11/h7-10,12H,2-6H2,1H3/t7?,8?,9-,10+/m1/s1
InChIKeyLVGLGTGQLSRXTI-BMNUFHGDSA-N
MW171.26 g/mol
LogP2.27
Rot. Bonds2

About cis-(1S,2R)-2-fluoro-N-(3-methylcyclobutyl)cyclopentan-1-amine

cis-(1S,2R)-2-fluoro-N-(3-methylcyclobutyl)cyclopentan-1-amine (PubChem CID 130921555) has the molecular formula C10H18FN and a molecular weight of 171.26 g/mol. Its IUPAC name is cis-(1S,2R)-2-fluoro-N-(3-methylcyclobutyl)cyclopentan-1-amine.

Molecular Properties

Compound Namecis-(1S,2R)-2-fluoro-N-(3-methylcyclobutyl)cyclopentan-1-amine
PubChem CID130921555
Molecular FormulaC10H18FN
Molecular Weight171.26 g/mol
Exact Mass171.14
IUPAC Namecis-(1S,2R)-2-fluoro-N-(3-methylcyclobutyl)cyclopentan-1-amine
SMILESCC1CC(N[C@H]2CCC[C@H]2F)C1
InChIInChI=1S/C10H18FN/c1-7-5-8(6-7)12-10-4-2-3-9(10)11/h7-10,12H,2-6H2,1H3/t7?,8?,9-,10+/m1/s1
InChIKeyLVGLGTGQLSRXTI-BMNUFHGDSA-N
XLogP2.27
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.26
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of cis-(1S,2R)-2-fluoro-N-(3-methylcyclobutyl)cyclopentan-1-amine?
The IUPAC name of cis-(1S,2R)-2-fluoro-N-(3-methylcyclobutyl)cyclopentan-1-amine (CID 130921555) is cis-(1S,2R)-2-fluoro-N-(3-methylcyclobutyl)cyclopentan-1-amine.
What is the SMILES notation for cis-(1S,2R)-2-fluoro-N-(3-methylcyclobutyl)cyclopentan-1-amine?
The canonical SMILES for cis-(1S,2R)-2-fluoro-N-(3-methylcyclobutyl)cyclopentan-1-amine is CC1CC(N[C@H]2CCC[C@H]2F)C1.
What is the InChIKey of cis-(1S,2R)-2-fluoro-N-(3-methylcyclobutyl)cyclopentan-1-amine?
The InChIKey is LVGLGTGQLSRXTI-BMNUFHGDSA-N. The full InChI is InChI=1S/C10H18FN/c1-7-5-8(6-7)12-10-4-2-3-9(10)11/h7-10,12H,2-6H2,1H3/t7?,8?,9-,10+/m1/s1.
What are the key properties of cis-(1S,2R)-2-fluoro-N-(3-methylcyclobutyl)cyclopentan-1-amine?
cis-(1S,2R)-2-fluoro-N-(3-methylcyclobutyl)cyclopentan-1-amine has a molecular weight of 171.26 g/mol, XLogP of 2.27, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1S,2R)-2-fluoro-N-(3-methylcyclobutyl)cyclopentan-1-amine is sourced from PubChem (CID 130921555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).