N,N,2-trimethyl-6-oxa-2-azabicyclo[3.2.0]heptane-4-carboxamide

C9H16N2O2 — CID 166145246

IUPACN,N,2-trimethyl-6-oxa-2-azabicyclo[3.2.0]heptane-4-carboxamide
SMILESCN(C)C(=O)C1CN(C)C2COC12
InChIInChI=1S/C9H16N2O2/c1-10(2)9(12)6-4-11(3)7-5-13-8(6)7/h6-8H,4-5H2,1-3H3
InChIKeyYNPWGRRVFGRITD-UHFFFAOYSA-N
MW184.24 g/mol
LogP-0.60
Rot. Bonds1

About N,N,2-trimethyl-6-oxa-2-azabicyclo[3.2.0]heptane-4-carboxamide

N,N,2-trimethyl-6-oxa-2-azabicyclo[3.2.0]heptane-4-carboxamide (PubChem CID 166145246) has the molecular formula C9H16N2O2 and a molecular weight of 184.24 g/mol. Its IUPAC name is N,N,2-trimethyl-6-oxa-2-azabicyclo[3.2.0]heptane-4-carboxamide.

Molecular Properties

Compound NameN,N,2-trimethyl-6-oxa-2-azabicyclo[3.2.0]heptane-4-carboxamide
PubChem CID166145246
Molecular FormulaC9H16N2O2
Molecular Weight184.24 g/mol
Exact Mass184.12
IUPAC NameN,N,2-trimethyl-6-oxa-2-azabicyclo[3.2.0]heptane-4-carboxamide
SMILESCN(C)C(=O)C1CN(C)C2COC12
InChIInChI=1S/C9H16N2O2/c1-10(2)9(12)6-4-11(3)7-5-13-8(6)7/h6-8H,4-5H2,1-3H3
InChIKeyYNPWGRRVFGRITD-UHFFFAOYSA-N
XLogP-0.60
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.24
LogP ≤ 5-0.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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N,N-dimethyl-4-propylmorpholine-2-carboxamide
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N,N-dimethyl-2-(methylamino)cyclohexane-1-carboxamide
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(2S,3S)-2-ethyl-N,N-dimethyloxane-3-carboxamide
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N,N-dimethyl-1-(oxiran-2-ylmethyl)piperidine-3-carboxamide
CID 102548593
tert-butyl 6-(dimethylcarbamoyl)-3-azabicyclo[3.1.0]hexane-3-carboxylate
CID 69499244
N,N,2-trimethyl-1,3,4,4a,5,6,7,8,9,9a-decahydrocyclohepta[c]pyridine-3-carboxamide
CID 20624795
2-amino-N,N-dimethylcyclopentane-1-carboxamide
CID 59215971
(3R,4R)-N,N,4-trimethylpyrrolidine-3-carboxamide
CID 66936245
(1S,5R,6S)-3-ethylsulfonyl-N,N-dimethyl-8-oxa-3-azabicyclo[3.2.1]octane-6-carboxamide
CID 155545809

Frequently Asked Questions

What is the IUPAC name of N,N,2-trimethyl-6-oxa-2-azabicyclo[3.2.0]heptane-4-carboxamide?
The IUPAC name of N,N,2-trimethyl-6-oxa-2-azabicyclo[3.2.0]heptane-4-carboxamide (CID 166145246) is N,N,2-trimethyl-6-oxa-2-azabicyclo[3.2.0]heptane-4-carboxamide.
What is the SMILES notation for N,N,2-trimethyl-6-oxa-2-azabicyclo[3.2.0]heptane-4-carboxamide?
The canonical SMILES for N,N,2-trimethyl-6-oxa-2-azabicyclo[3.2.0]heptane-4-carboxamide is CN(C)C(=O)C1CN(C)C2COC12.
What is the InChIKey of N,N,2-trimethyl-6-oxa-2-azabicyclo[3.2.0]heptane-4-carboxamide?
The InChIKey is YNPWGRRVFGRITD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O2/c1-10(2)9(12)6-4-11(3)7-5-13-8(6)7/h6-8H,4-5H2,1-3H3.
What are the key properties of N,N,2-trimethyl-6-oxa-2-azabicyclo[3.2.0]heptane-4-carboxamide?
N,N,2-trimethyl-6-oxa-2-azabicyclo[3.2.0]heptane-4-carboxamide has a molecular weight of 184.24 g/mol, XLogP of -0.60, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,2-trimethyl-6-oxa-2-azabicyclo[3.2.0]heptane-4-carboxamide is sourced from PubChem (CID 166145246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).