N-(6-amino-2-oxabicyclo[3.2.0]heptan-7-yl)-2-(2-chlorophenyl)acetamide

C14H17ClN2O2 — CID 66195362

IUPACN-(6-amino-2-oxabicyclo[3.2.0]heptan-7-yl)-2-(2-chlorophenyl)acetamide
SMILESNC1C2CCOC2C1NC(=O)Cc1ccccc1Cl
InChIInChI=1S/C14H17ClN2O2/c15-10-4-2-1-3-8(10)7-11(18)17-13-12(16)9-5-6-19-14(9)13/h1-4,9,12-14H,5-7,16H2,(H,17,18)
InChIKeyBIILNYWPZNRZOA-UHFFFAOYSA-N
MW280.75 g/mol
LogP1.11
Rot. Bonds3

About N-(6-amino-2-oxabicyclo[3.2.0]heptan-7-yl)-2-(2-chlorophenyl)acetamide

N-(6-amino-2-oxabicyclo[3.2.0]heptan-7-yl)-2-(2-chlorophenyl)acetamide (PubChem CID 66195362) has the molecular formula C14H17ClN2O2 and a molecular weight of 280.75 g/mol. Its IUPAC name is N-(6-amino-2-oxabicyclo[3.2.0]heptan-7-yl)-2-(2-chlorophenyl)acetamide.

Molecular Properties

Compound NameN-(6-amino-2-oxabicyclo[3.2.0]heptan-7-yl)-2-(2-chlorophenyl)acetamide
PubChem CID66195362
Molecular FormulaC14H17ClN2O2
Molecular Weight280.75 g/mol
Exact Mass280.10
IUPAC NameN-(6-amino-2-oxabicyclo[3.2.0]heptan-7-yl)-2-(2-chlorophenyl)acetamide
SMILESNC1C2CCOC2C1NC(=O)Cc1ccccc1Cl
InChIInChI=1S/C14H17ClN2O2/c15-10-4-2-1-3-8(10)7-11(18)17-13-12(16)9-5-6-19-14(9)13/h1-4,9,12-14H,5-7,16H2,(H,17,18)
InChIKeyBIILNYWPZNRZOA-UHFFFAOYSA-N
XLogP1.11
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.75
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(6-amino-2-oxabicyclo[3.2.0]heptan-7-yl)-2,6-dichlorobenzamide
CID 66194783
N-(6-amino-2-oxabicyclo[3.2.0]heptan-7-yl)-2-(3,4-dimethylphenyl)acetamide
CID 66194959
N-(7-amino-2-oxabicyclo[4.2.0]octan-8-yl)-2-thiophen-2-ylacetamide
CID 66210558
2-[(2-chlorophenyl)methylsulfanyl]-N-[(1R,5S,6R,7R)-7-ethyl-2-oxabicyclo[3.2.0]heptan-6-yl]acetamide
CID 91761779
N-[(1R,5R,6S,7R)-6-amino-2-oxabicyclo[3.2.0]heptan-7-yl]-5-chlorothiophene-2-carboxamide
CID 91795247
N-(6-amino-2-oxabicyclo[3.2.0]heptan-7-yl)naphthalene-2-carboxamide
CID 66195955
2-[(2-chlorophenyl)methylsulfanyl]-N-[(1R,5R,6S,7R)-7-pyrrolidin-1-yl-2-oxabicyclo[3.2.0]heptan-6-yl]acetamide
CID 91769076
1-(6-amino-2-oxabicyclo[3.2.0]heptan-7-yl)-3-(3-chloro-4-methylphenyl)urea
CID 66196336
N-(6-amino-2-oxabicyclo[3.2.0]heptan-7-yl)cyclopentanecarboxamide
CID 66197662
2-(2-chlorophenyl)-N-[(3R,4R)-3-(oxan-4-yl)oxan-4-yl]acetamide
CID 133265749
N-(6-amino-2-oxabicyclo[3.2.0]heptan-7-yl)cyclooctanecarboxamide
CID 66195942
N-[(1R,5R,6S,7R)-6-amino-2-oxabicyclo[3.2.0]heptan-7-yl]-2-(4-methyl-N-methylsulfonylanilino)acetamide
CID 91778611

Frequently Asked Questions

What is the IUPAC name of N-(6-amino-2-oxabicyclo[3.2.0]heptan-7-yl)-2-(2-chlorophenyl)acetamide?
The IUPAC name of N-(6-amino-2-oxabicyclo[3.2.0]heptan-7-yl)-2-(2-chlorophenyl)acetamide (CID 66195362) is N-(6-amino-2-oxabicyclo[3.2.0]heptan-7-yl)-2-(2-chlorophenyl)acetamide.
What is the SMILES notation for N-(6-amino-2-oxabicyclo[3.2.0]heptan-7-yl)-2-(2-chlorophenyl)acetamide?
The canonical SMILES for N-(6-amino-2-oxabicyclo[3.2.0]heptan-7-yl)-2-(2-chlorophenyl)acetamide is NC1C2CCOC2C1NC(=O)Cc1ccccc1Cl.
What is the InChIKey of N-(6-amino-2-oxabicyclo[3.2.0]heptan-7-yl)-2-(2-chlorophenyl)acetamide?
The InChIKey is BIILNYWPZNRZOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17ClN2O2/c15-10-4-2-1-3-8(10)7-11(18)17-13-12(16)9-5-6-19-14(9)13/h1-4,9,12-14H,5-7,16H2,(H,17,18).
What are the key properties of N-(6-amino-2-oxabicyclo[3.2.0]heptan-7-yl)-2-(2-chlorophenyl)acetamide?
N-(6-amino-2-oxabicyclo[3.2.0]heptan-7-yl)-2-(2-chlorophenyl)acetamide has a molecular weight of 280.75 g/mol, XLogP of 1.11, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-amino-2-oxabicyclo[3.2.0]heptan-7-yl)-2-(2-chlorophenyl)acetamide is sourced from PubChem (CID 66195362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).