(1S,5R)-N-ethyl-3-azabicyclo[3.1.0]hexane-6-carboxamide

C8H14N2O — CID 131207269

IUPAC(1S,5R)-N-ethyl-3-azabicyclo[3.1.0]hexane-6-carboxamide
SMILESCCNC(=O)C1[C@H]2CNC[C@@H]12
InChIInChI=1S/C8H14N2O/c1-2-10-8(11)7-5-3-9-4-6(5)7/h5-7,9H,2-4H2,1H3,(H,10,11)/t5-,6+,7?
InChIKeyQZLMAGPGXZZSKW-MEKDEQNOSA-N
MW154.21 g/mol
LogP-0.41
Rot. Bonds2

About (1S,5R)-N-ethyl-3-azabicyclo[3.1.0]hexane-6-carboxamide

(1S,5R)-N-ethyl-3-azabicyclo[3.1.0]hexane-6-carboxamide (PubChem CID 131207269) has the molecular formula C8H14N2O and a molecular weight of 154.21 g/mol. Its IUPAC name is (1S,5R)-N-ethyl-3-azabicyclo[3.1.0]hexane-6-carboxamide.

Molecular Properties

Compound Name(1S,5R)-N-ethyl-3-azabicyclo[3.1.0]hexane-6-carboxamide
PubChem CID131207269
Molecular FormulaC8H14N2O
Molecular Weight154.21 g/mol
Exact Mass154.11
IUPAC Name(1S,5R)-N-ethyl-3-azabicyclo[3.1.0]hexane-6-carboxamide
SMILESCCNC(=O)C1[C@H]2CNC[C@@H]12
InChIInChI=1S/C8H14N2O/c1-2-10-8(11)7-5-3-9-4-6(5)7/h5-7,9H,2-4H2,1H3,(H,10,11)/t5-,6+,7?
InChIKeyQZLMAGPGXZZSKW-MEKDEQNOSA-N
XLogP-0.41
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.21
LogP ≤ 5-0.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethylbicyclo[3.1.0]hexane-6-carboxamide
CID 79600194
(1S,6S)-N-ethylbicyclo[4.1.0]heptane-7-carboxamide
CID 124567047
(4E)-N-ethylbicyclo[6.1.0]non-4-ene-9-carboxamide
CID 89182498
(1S,5R)-N-(2-methylbutan-2-yl)-3-azabicyclo[3.1.0]hexane-6-carboxamide
CID 130662861
N-(1,1,1-trifluoro-2-methylpropan-2-yl)-3-azabicyclo[3.1.0]hexane-6-carboxamide
CID 167524503
N-ethylpiperidine-3-carboxamide;hydrochloride
CID 53410852
N-ethyl-2,4,5-trimethyloxolane-3-carboxamide
CID 65155196
N-[(2R)-2-(ethylamino)propyl]bicyclo[3.1.0]hexane-6-carboxamide;hydrochloride
CID 120653330
(2R,4S)-N-ethyl-4-hydroxypyrrolidine-2-carboxamide
CID 28943534
azetidin-3-yl N-ethylcarbamate
CID 79338252
N-ethyl-2-methylmorpholine-3-carboxamide
CID 131071311
(2R,5S)-5-(ethylcarbamoyl)oxolane-2-carboxylic acid
CID 102944287

Frequently Asked Questions

What is the IUPAC name of (1S,5R)-N-ethyl-3-azabicyclo[3.1.0]hexane-6-carboxamide?
The IUPAC name of (1S,5R)-N-ethyl-3-azabicyclo[3.1.0]hexane-6-carboxamide (CID 131207269) is (1S,5R)-N-ethyl-3-azabicyclo[3.1.0]hexane-6-carboxamide.
What is the SMILES notation for (1S,5R)-N-ethyl-3-azabicyclo[3.1.0]hexane-6-carboxamide?
The canonical SMILES for (1S,5R)-N-ethyl-3-azabicyclo[3.1.0]hexane-6-carboxamide is CCNC(=O)C1[C@H]2CNC[C@@H]12.
What is the InChIKey of (1S,5R)-N-ethyl-3-azabicyclo[3.1.0]hexane-6-carboxamide?
The InChIKey is QZLMAGPGXZZSKW-MEKDEQNOSA-N. The full InChI is InChI=1S/C8H14N2O/c1-2-10-8(11)7-5-3-9-4-6(5)7/h5-7,9H,2-4H2,1H3,(H,10,11)/t5-,6+,7?.
What are the key properties of (1S,5R)-N-ethyl-3-azabicyclo[3.1.0]hexane-6-carboxamide?
(1S,5R)-N-ethyl-3-azabicyclo[3.1.0]hexane-6-carboxamide has a molecular weight of 154.21 g/mol, XLogP of -0.41, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1S,5R)-N-ethyl-3-azabicyclo[3.1.0]hexane-6-carboxamide is sourced from PubChem (CID 131207269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).