N-(3-ethyl-1-bicyclo[1.1.1]pentanyl)cyclopropanecarboxamide

C11H17NO — CID 130444150

IUPACN-(3-ethyl-1-bicyclo[1.1.1]pentanyl)cyclopropanecarboxamide
SMILESCCC12CC(NC(=O)C3CC3)(C1)C2
InChIInChI=1S/C11H17NO/c1-2-10-5-11(6-10,7-10)12-9(13)8-3-4-8/h8H,2-7H2,1H3,(H,12,13)
InChIKeyFOSOJJOHPBCRPP-UHFFFAOYSA-N
MW179.26 g/mol
LogP1.85
Rot. Bonds3

About N-(3-ethyl-1-bicyclo[1.1.1]pentanyl)cyclopropanecarboxamide

N-(3-ethyl-1-bicyclo[1.1.1]pentanyl)cyclopropanecarboxamide (PubChem CID 130444150) has the molecular formula C11H17NO and a molecular weight of 179.26 g/mol. Its IUPAC name is N-(3-ethyl-1-bicyclo[1.1.1]pentanyl)cyclopropanecarboxamide.

Molecular Properties

Compound NameN-(3-ethyl-1-bicyclo[1.1.1]pentanyl)cyclopropanecarboxamide
PubChem CID130444150
Molecular FormulaC11H17NO
Molecular Weight179.26 g/mol
Exact Mass179.13
IUPAC NameN-(3-ethyl-1-bicyclo[1.1.1]pentanyl)cyclopropanecarboxamide
SMILESCCC12CC(NC(=O)C3CC3)(C1)C2
InChIInChI=1S/C11H17NO/c1-2-10-5-11(6-10,7-10)12-9(13)8-3-4-8/h8H,2-7H2,1H3,(H,12,13)
InChIKeyFOSOJJOHPBCRPP-UHFFFAOYSA-N
XLogP1.85
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.26
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(3-ethyl-1-bicyclo[1.1.1]pentanyl)cyclopropanecarboxamide?
The IUPAC name of N-(3-ethyl-1-bicyclo[1.1.1]pentanyl)cyclopropanecarboxamide (CID 130444150) is N-(3-ethyl-1-bicyclo[1.1.1]pentanyl)cyclopropanecarboxamide.
What is the SMILES notation for N-(3-ethyl-1-bicyclo[1.1.1]pentanyl)cyclopropanecarboxamide?
The canonical SMILES for N-(3-ethyl-1-bicyclo[1.1.1]pentanyl)cyclopropanecarboxamide is CCC12CC(NC(=O)C3CC3)(C1)C2.
What is the InChIKey of N-(3-ethyl-1-bicyclo[1.1.1]pentanyl)cyclopropanecarboxamide?
The InChIKey is FOSOJJOHPBCRPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO/c1-2-10-5-11(6-10,7-10)12-9(13)8-3-4-8/h8H,2-7H2,1H3,(H,12,13).
What are the key properties of N-(3-ethyl-1-bicyclo[1.1.1]pentanyl)cyclopropanecarboxamide?
N-(3-ethyl-1-bicyclo[1.1.1]pentanyl)cyclopropanecarboxamide has a molecular weight of 179.26 g/mol, XLogP of 1.85, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethyl-1-bicyclo[1.1.1]pentanyl)cyclopropanecarboxamide is sourced from PubChem (CID 130444150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).