N-ethylbicyclo[3.1.0]hexane-6-carboxamide

C9H15NO — CID 79600194

IUPACN-ethylbicyclo[3.1.0]hexane-6-carboxamide
SMILESCCNC(=O)C1C2CCCC21
InChIInChI=1S/C9H15NO/c1-2-10-9(11)8-6-4-3-5-7(6)8/h6-8H,2-5H2,1H3,(H,10,11)
InChIKeyZSFUXTIZNVJJFY-UHFFFAOYSA-N
MW153.22 g/mol
LogP1.17
Rot. Bonds2

About N-ethylbicyclo[3.1.0]hexane-6-carboxamide

N-ethylbicyclo[3.1.0]hexane-6-carboxamide (PubChem CID 79600194) has the molecular formula C9H15NO and a molecular weight of 153.22 g/mol. Its IUPAC name is N-ethylbicyclo[3.1.0]hexane-6-carboxamide.

Molecular Properties

Compound NameN-ethylbicyclo[3.1.0]hexane-6-carboxamide
PubChem CID79600194
Molecular FormulaC9H15NO
Molecular Weight153.22 g/mol
Exact Mass153.12
IUPAC NameN-ethylbicyclo[3.1.0]hexane-6-carboxamide
SMILESCCNC(=O)C1C2CCCC21
InChIInChI=1S/C9H15NO/c1-2-10-9(11)8-6-4-3-5-7(6)8/h6-8H,2-5H2,1H3,(H,10,11)
InChIKeyZSFUXTIZNVJJFY-UHFFFAOYSA-N
XLogP1.17
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.22
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(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-ethyl-3-azabicyclo[3.1.0]hexane-6-carboxamide
CID 131207269
N-[(2R)-2-(ethylamino)propyl]bicyclo[3.1.0]hexane-6-carboxamide;hydrochloride
CID 120653330
N-(2-amino-2-ethylbutyl)bicyclo[3.1.0]hexane-6-carboxamide;hydrochloride
CID 119640656
N-(2-hydroxy-2-propylpentyl)bicyclo[3.1.0]hexane-6-carboxamide
CID 111750779
N-prop-2-ynylbicyclo[4.1.0]heptane-7-carboxamide
CID 79139027
N-[2-(methylamino)ethyl]bicyclo[4.1.0]heptane-7-carboxamide
CID 81478899
3-(bicyclo[3.1.0]hexane-6-carbonylamino)propanoic acid
CID 81454952
N-(3-chloro-2,2-dimethylpropyl)bicyclo[3.1.0]hexane-6-carboxamide
CID 115364638
N-(piperidin-2-ylmethyl)bicyclo[3.1.0]hexane-6-carboxamide
CID 81479063
N-ethylcyclohex-2-ene-1-carboxamide
CID 130738610

Frequently Asked Questions

What is the IUPAC name of N-ethylbicyclo[3.1.0]hexane-6-carboxamide?
The IUPAC name of N-ethylbicyclo[3.1.0]hexane-6-carboxamide (CID 79600194) is N-ethylbicyclo[3.1.0]hexane-6-carboxamide.
What is the SMILES notation for N-ethylbicyclo[3.1.0]hexane-6-carboxamide?
The canonical SMILES for N-ethylbicyclo[3.1.0]hexane-6-carboxamide is CCNC(=O)C1C2CCCC21.
What is the InChIKey of N-ethylbicyclo[3.1.0]hexane-6-carboxamide?
The InChIKey is ZSFUXTIZNVJJFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO/c1-2-10-9(11)8-6-4-3-5-7(6)8/h6-8H,2-5H2,1H3,(H,10,11).
What are the key properties of N-ethylbicyclo[3.1.0]hexane-6-carboxamide?
N-ethylbicyclo[3.1.0]hexane-6-carboxamide has a molecular weight of 153.22 g/mol, XLogP of 1.17, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethylbicyclo[3.1.0]hexane-6-carboxamide is sourced from PubChem (CID 79600194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).