N-(1,2-oxazol-3-ylmethyl)bicyclo[3.1.0]hexane-3-carboxamide

C11H14N2O2 — CID 81173501

IUPACN-(1,2-oxazol-3-ylmethyl)bicyclo[3.1.0]hexane-3-carboxamide
SMILESO=C(NCc1ccon1)C1CC2CC2C1
InChIInChI=1S/C11H14N2O2/c14-11(9-4-7-3-8(7)5-9)12-6-10-1-2-15-13-10/h1-2,7-9H,3-6H2,(H,12,14)
InChIKeyBEBXNHZCXGYPOF-UHFFFAOYSA-N
MW206.24 g/mol
LogP1.34
Rot. Bonds3

About N-(1,2-oxazol-3-ylmethyl)bicyclo[3.1.0]hexane-3-carboxamide

N-(1,2-oxazol-3-ylmethyl)bicyclo[3.1.0]hexane-3-carboxamide (PubChem CID 81173501) has the molecular formula C11H14N2O2 and a molecular weight of 206.24 g/mol. Its IUPAC name is N-(1,2-oxazol-3-ylmethyl)bicyclo[3.1.0]hexane-3-carboxamide.

Molecular Properties

Compound NameN-(1,2-oxazol-3-ylmethyl)bicyclo[3.1.0]hexane-3-carboxamide
PubChem CID81173501
Molecular FormulaC11H14N2O2
Molecular Weight206.24 g/mol
Exact Mass206.11
IUPAC NameN-(1,2-oxazol-3-ylmethyl)bicyclo[3.1.0]hexane-3-carboxamide
SMILESO=C(NCc1ccon1)C1CC2CC2C1
InChIInChI=1S/C11H14N2O2/c14-11(9-4-7-3-8(7)5-9)12-6-10-1-2-15-13-10/h1-2,7-9H,3-6H2,(H,12,14)
InChIKeyBEBXNHZCXGYPOF-UHFFFAOYSA-N
XLogP1.34
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.24
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1,2-oxazol-3-ylmethylcarbamoyl)cyclopentane-1-carboxylic acid
CID 103978996
N-(1,2-oxazol-3-ylmethyl)piperidine-2-carboxamide
CID 81170885
3-(1,2-oxazol-3-ylmethylcarbamoylamino)cyclopentane-1-carboxylic acid
CID 81178610
1-amino-3-(1,2-oxazol-3-ylmethyl)urea
CID 81177768
1-methyl-N-(1,2-oxazol-3-ylmethyl)cyclopropane-1-carboxamide
CID 131086599
N-(1,2-oxazol-3-ylmethyl)azetidine-1-carboxamide
CID 131176570
2-(methylamino)-N-(1,2-oxazol-3-ylmethyl)acetamide
CID 81171210
2-methyl-1-(1,2-oxazol-3-ylmethylcarbamoyl)piperidine-4-carboxylic acid
CID 106744445
N-(1,2-oxazol-3-ylmethyl)-4-oxopentanamide
CID 79493303
1-(1,2-oxazol-3-ylmethyl)-3-propylurea
CID 115672343
1-(1,2-oxazol-3-ylmethylcarbamoyl)piperidine-2-carboxylic acid
CID 81178491
(5S)-N-(1,2-oxazol-3-ylmethyl)-3-(2-phenylethyl)-4,5-dihydro-1,2-oxazole-5-carboxamide
CID 26320564

Frequently Asked Questions

What is the IUPAC name of N-(1,2-oxazol-3-ylmethyl)bicyclo[3.1.0]hexane-3-carboxamide?
The IUPAC name of N-(1,2-oxazol-3-ylmethyl)bicyclo[3.1.0]hexane-3-carboxamide (CID 81173501) is N-(1,2-oxazol-3-ylmethyl)bicyclo[3.1.0]hexane-3-carboxamide.
What is the SMILES notation for N-(1,2-oxazol-3-ylmethyl)bicyclo[3.1.0]hexane-3-carboxamide?
The canonical SMILES for N-(1,2-oxazol-3-ylmethyl)bicyclo[3.1.0]hexane-3-carboxamide is O=C(NCc1ccon1)C1CC2CC2C1.
What is the InChIKey of N-(1,2-oxazol-3-ylmethyl)bicyclo[3.1.0]hexane-3-carboxamide?
The InChIKey is BEBXNHZCXGYPOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O2/c14-11(9-4-7-3-8(7)5-9)12-6-10-1-2-15-13-10/h1-2,7-9H,3-6H2,(H,12,14).
What are the key properties of N-(1,2-oxazol-3-ylmethyl)bicyclo[3.1.0]hexane-3-carboxamide?
N-(1,2-oxazol-3-ylmethyl)bicyclo[3.1.0]hexane-3-carboxamide has a molecular weight of 206.24 g/mol, XLogP of 1.34, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,2-oxazol-3-ylmethyl)bicyclo[3.1.0]hexane-3-carboxamide is sourced from PubChem (CID 81173501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).