5-(fluoromethyl)-2-azabicyclo[3.1.0]hexane-3-carboxamide

C7H11FN2O — CID 168853041

IUPAC5-(fluoromethyl)-2-azabicyclo[3.1.0]hexane-3-carboxamide
SMILESNC(=O)C1CC2(CF)CC2N1
InChIInChI=1S/C7H11FN2O/c8-3-7-1-4(6(9)11)10-5(7)2-7/h4-5,10H,1-3H2,(H2,9,11)
InChIKeyYIZFZRZXYVLFHL-UHFFFAOYSA-N
MW158.18 g/mol
LogP-0.44
Rot. Bonds2

About 5-(fluoromethyl)-2-azabicyclo[3.1.0]hexane-3-carboxamide

5-(fluoromethyl)-2-azabicyclo[3.1.0]hexane-3-carboxamide (PubChem CID 168853041) has the molecular formula C7H11FN2O and a molecular weight of 158.18 g/mol. Its IUPAC name is 5-(fluoromethyl)-2-azabicyclo[3.1.0]hexane-3-carboxamide.

Molecular Properties

Compound Name5-(fluoromethyl)-2-azabicyclo[3.1.0]hexane-3-carboxamide
PubChem CID168853041
Molecular FormulaC7H11FN2O
Molecular Weight158.18 g/mol
Exact Mass158.09
IUPAC Name5-(fluoromethyl)-2-azabicyclo[3.1.0]hexane-3-carboxamide
SMILESNC(=O)C1CC2(CF)CC2N1
InChIInChI=1S/C7H11FN2O/c8-3-7-1-4(6(9)11)10-5(7)2-7/h4-5,10H,1-3H2,(H2,9,11)
InChIKeyYIZFZRZXYVLFHL-UHFFFAOYSA-N
XLogP-0.44
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.18
LogP ≤ 5-0.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(1S,3S,5S)-2-Azabicyclo(3.1.0)hexane-3-carboxamide
CID 11506821
2-Azabicyclo(3.1.0)hexane-3-carboxamide, (1S,3S,5S)-
CID 21094662
4,5-Methano-l-proline amide
CID 21338924
6,6-Dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxamide
CID 66735461
1-Fluoro-2-azabicyclo[2.2.1]heptane-3-carboxamide
CID 123996987
(4,4-dimethylpiperidin-2-yl)-[(3S)-3-fluoropyrrolidin-1-yl]methanone
CID 141797365
1-(3-Fluoropropyl)-2-azabicyclo[3.1.0]hexane-3-carboxamide
CID 162459682
1-[(3-Fluoropropylamino)methyl]-2-azabicyclo[3.1.0]hexane-3-carboxamide
CID 162459705
1-(2,2-Difluoroethyl)-2-azabicyclo[3.1.0]hexane-3-carboxamide
CID 162459711
1-(Fluoromethyl)-2-azabicyclo[3.1.0]hexane-3-carboxamide
CID 162459717
1-(2-Fluoroethyl)-2-azabicyclo[3.1.0]hexane-3-carboxamide
CID 162459729
(3S,6S)-2,2-difluoro-5-azaspiro[2.4]heptane-6-carboxamide
CID 166937053

Frequently Asked Questions

What is the IUPAC name of 5-(fluoromethyl)-2-azabicyclo[3.1.0]hexane-3-carboxamide?
The IUPAC name of 5-(fluoromethyl)-2-azabicyclo[3.1.0]hexane-3-carboxamide (CID 168853041) is 5-(fluoromethyl)-2-azabicyclo[3.1.0]hexane-3-carboxamide.
What is the SMILES notation for 5-(fluoromethyl)-2-azabicyclo[3.1.0]hexane-3-carboxamide?
The canonical SMILES for 5-(fluoromethyl)-2-azabicyclo[3.1.0]hexane-3-carboxamide is NC(=O)C1CC2(CF)CC2N1.
What is the InChIKey of 5-(fluoromethyl)-2-azabicyclo[3.1.0]hexane-3-carboxamide?
The InChIKey is YIZFZRZXYVLFHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11FN2O/c8-3-7-1-4(6(9)11)10-5(7)2-7/h4-5,10H,1-3H2,(H2,9,11).
What are the key properties of 5-(fluoromethyl)-2-azabicyclo[3.1.0]hexane-3-carboxamide?
5-(fluoromethyl)-2-azabicyclo[3.1.0]hexane-3-carboxamide has a molecular weight of 158.18 g/mol, XLogP of -0.44, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(fluoromethyl)-2-azabicyclo[3.1.0]hexane-3-carboxamide is sourced from PubChem (CID 168853041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).