N-[(1-fluorocyclopropyl)methyl]-5-azaspiro[2.4]heptane-5-carboxamide

C11H17FN2O — CID 170193670

IUPACN-[(1-fluorocyclopropyl)methyl]-5-azaspiro[2.4]heptane-5-carboxamide
SMILESO=C(NCC1(F)CC1)N1CCC2(CC2)C1
InChIInChI=1S/C11H17FN2O/c12-11(3-4-11)7-13-9(15)14-6-5-10(8-14)1-2-10/h1-8H2,(H,13,15)
InChIKeyUFZZIRAWXFIHPK-UHFFFAOYSA-N
MW212.27 g/mol
LogP1.68
Rot. Bonds2

About N-[(1-fluorocyclopropyl)methyl]-5-azaspiro[2.4]heptane-5-carboxamide

N-[(1-fluorocyclopropyl)methyl]-5-azaspiro[2.4]heptane-5-carboxamide (PubChem CID 170193670) has the molecular formula C11H17FN2O and a molecular weight of 212.27 g/mol. Its IUPAC name is N-[(1-fluorocyclopropyl)methyl]-5-azaspiro[2.4]heptane-5-carboxamide.

Molecular Properties

Compound NameN-[(1-fluorocyclopropyl)methyl]-5-azaspiro[2.4]heptane-5-carboxamide
PubChem CID170193670
Molecular FormulaC11H17FN2O
Molecular Weight212.27 g/mol
Exact Mass212.13
IUPAC NameN-[(1-fluorocyclopropyl)methyl]-5-azaspiro[2.4]heptane-5-carboxamide
SMILESO=C(NCC1(F)CC1)N1CCC2(CC2)C1
InChIInChI=1S/C11H17FN2O/c12-11(3-4-11)7-13-9(15)14-6-5-10(8-14)1-2-10/h1-8H2,(H,13,15)
InChIKeyUFZZIRAWXFIHPK-UHFFFAOYSA-N
XLogP1.68
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.27
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-[(1-fluorocyclopropyl)methyl]-5-azaspiro[2.4]heptane-5-carboxamide?
The IUPAC name of N-[(1-fluorocyclopropyl)methyl]-5-azaspiro[2.4]heptane-5-carboxamide (CID 170193670) is N-[(1-fluorocyclopropyl)methyl]-5-azaspiro[2.4]heptane-5-carboxamide.
What is the SMILES notation for N-[(1-fluorocyclopropyl)methyl]-5-azaspiro[2.4]heptane-5-carboxamide?
The canonical SMILES for N-[(1-fluorocyclopropyl)methyl]-5-azaspiro[2.4]heptane-5-carboxamide is O=C(NCC1(F)CC1)N1CCC2(CC2)C1.
What is the InChIKey of N-[(1-fluorocyclopropyl)methyl]-5-azaspiro[2.4]heptane-5-carboxamide?
The InChIKey is UFZZIRAWXFIHPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17FN2O/c12-11(3-4-11)7-13-9(15)14-6-5-10(8-14)1-2-10/h1-8H2,(H,13,15).
What are the key properties of N-[(1-fluorocyclopropyl)methyl]-5-azaspiro[2.4]heptane-5-carboxamide?
N-[(1-fluorocyclopropyl)methyl]-5-azaspiro[2.4]heptane-5-carboxamide has a molecular weight of 212.27 g/mol, XLogP of 1.68, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-fluorocyclopropyl)methyl]-5-azaspiro[2.4]heptane-5-carboxamide is sourced from PubChem (CID 170193670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).