N,N-diethyl-5,6-dihydro-4H-1,3-oxazine-2-carboxamide

C9H16N2O2 — CID 20523804

IUPACN,N-diethyl-5,6-dihydro-4H-1,3-oxazine-2-carboxamide
SMILESCCN(CC)C(=O)C1=NCCCO1
InChIInChI=1S/C9H16N2O2/c1-3-11(4-2)9(12)8-10-6-5-7-13-8/h3-7H2,1-2H3
InChIKeyGVZDCISCNXESQA-UHFFFAOYSA-N
MW184.24 g/mol
LogP0.67
Rot. Bonds3

About N,N-diethyl-5,6-dihydro-4H-1,3-oxazine-2-carboxamide

N,N-diethyl-5,6-dihydro-4H-1,3-oxazine-2-carboxamide (PubChem CID 20523804) has the molecular formula C9H16N2O2 and a molecular weight of 184.24 g/mol. Its IUPAC name is N,N-diethyl-5,6-dihydro-4H-1,3-oxazine-2-carboxamide.

Molecular Properties

Compound NameN,N-diethyl-5,6-dihydro-4H-1,3-oxazine-2-carboxamide
PubChem CID20523804
Molecular FormulaC9H16N2O2
Molecular Weight184.24 g/mol
Exact Mass184.12
IUPAC NameN,N-diethyl-5,6-dihydro-4H-1,3-oxazine-2-carboxamide
SMILESCCN(CC)C(=O)C1=NCCCO1
InChIInChI=1S/C9H16N2O2/c1-3-11(4-2)9(12)8-10-6-5-7-13-8/h3-7H2,1-2H3
InChIKeyGVZDCISCNXESQA-UHFFFAOYSA-N
XLogP0.67
TPSA41.90 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.24
LogP ≤ 50.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-(diethylamino)-2-oxoethoxy)-N,N-diethylacetamide
CID 12729092
2-ethoxy-N,N-dipropylacetamide
CID 4102599
N,N-dimethyl-5,6-dihydro-4H-1,3-oxazine-2-carboxamide
CID 20523766
N,N-bis(2-methylprop-2-enyl)-5,6-dihydro-4H-1,3-oxazine-2-carboxamide
CID 20523772
N,N-bis[(E)-but-2-enyl]-5,6-dihydro-4H-1,3-oxazine-2-carboxamide
CID 20523778
N,N-diethyl-4,5-dimethyl-5,6-dihydro-4H-1,3-oxazine-2-carboxamide
CID 20523806
N,N-diethyl-4,4-dimethyl-5H-1,3-oxazole-2-carboxamide
CID 20523815
N,N-diethyl-4,5-dihydro-1,3-oxazole-2-carboxamide
CID 20523824
2-propoxy-N,N-dipropylacetamide
CID 48656359
1-Morpholin-4-yl-2-propoxyethanone
CID 54275056
N,N-bis(but-2-enyl)-5,6-dihydro-4H-1,3-oxazine-2-carboxamide
CID 54456551
2-ethoxy-N-methyl-N-propylacetamide
CID 62049286

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-5,6-dihydro-4H-1,3-oxazine-2-carboxamide?
The IUPAC name of N,N-diethyl-5,6-dihydro-4H-1,3-oxazine-2-carboxamide (CID 20523804) is N,N-diethyl-5,6-dihydro-4H-1,3-oxazine-2-carboxamide.
What is the SMILES notation for N,N-diethyl-5,6-dihydro-4H-1,3-oxazine-2-carboxamide?
The canonical SMILES for N,N-diethyl-5,6-dihydro-4H-1,3-oxazine-2-carboxamide is CCN(CC)C(=O)C1=NCCCO1.
What is the InChIKey of N,N-diethyl-5,6-dihydro-4H-1,3-oxazine-2-carboxamide?
The InChIKey is GVZDCISCNXESQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O2/c1-3-11(4-2)9(12)8-10-6-5-7-13-8/h3-7H2,1-2H3.
What are the key properties of N,N-diethyl-5,6-dihydro-4H-1,3-oxazine-2-carboxamide?
N,N-diethyl-5,6-dihydro-4H-1,3-oxazine-2-carboxamide has a molecular weight of 184.24 g/mol, XLogP of 0.67, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-5,6-dihydro-4H-1,3-oxazine-2-carboxamide is sourced from PubChem (CID 20523804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).