N-ethyl-2-methyl-2H-oxete-4-carboxamide

C7H11NO2 — CID 91411197

IUPACN-ethyl-2-methyl-2H-oxete-4-carboxamide
SMILESCCNC(=O)C1=CC(C)O1
InChIInChI=1S/C7H11NO2/c1-3-8-7(9)6-4-5(2)10-6/h4-5H,3H2,1-2H3,(H,8,9)
InChIKeyVUDRXFCMKLATDM-UHFFFAOYSA-N
MW141.17 g/mol
LogP0.43
Rot. Bonds2

About N-ethyl-2-methyl-2H-oxete-4-carboxamide

N-ethyl-2-methyl-2H-oxete-4-carboxamide (PubChem CID 91411197) has the molecular formula C7H11NO2 and a molecular weight of 141.17 g/mol. Its IUPAC name is N-ethyl-2-methyl-2H-oxete-4-carboxamide.

Molecular Properties

Compound NameN-ethyl-2-methyl-2H-oxete-4-carboxamide
PubChem CID91411197
Molecular FormulaC7H11NO2
Molecular Weight141.17 g/mol
Exact Mass141.08
IUPAC NameN-ethyl-2-methyl-2H-oxete-4-carboxamide
SMILESCCNC(=O)C1=CC(C)O1
InChIInChI=1S/C7H11NO2/c1-3-8-7(9)6-4-5(2)10-6/h4-5H,3H2,1-2H3,(H,8,9)
InChIKeyVUDRXFCMKLATDM-UHFFFAOYSA-N
XLogP0.43
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.17
LogP ≤ 50.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 134612800
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N,N-diethyl-2-methyl-2H-oxete-4-carboxamide
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N-ethyl-2-methyl-2,3-dihydrofuran-5-carboxamide
CID 164015740
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5-methoxy-2,3-dihydro-1H-pyridin-6-one
CID 14991076
1,5-Dihydro-3-methoxy-5-methyl-2H-pyrrol-2-one
CID 55286648
5-methoxy-N-(2-methoxyethyl)-4-oxo-4H-pyran-2-carboxamide
CID 99998918
6-Ethoxy-1,2,3,4-tetrahydroazepin-7-one
CID 130010189
N-but-2-ynyl-2,3-dihydrofuran-5-carboxamide
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N-ethyl-2,3-dihydrofuran-5-carboxamide
CID 130668490

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-methyl-2H-oxete-4-carboxamide?
The IUPAC name of N-ethyl-2-methyl-2H-oxete-4-carboxamide (CID 91411197) is N-ethyl-2-methyl-2H-oxete-4-carboxamide.
What is the SMILES notation for N-ethyl-2-methyl-2H-oxete-4-carboxamide?
The canonical SMILES for N-ethyl-2-methyl-2H-oxete-4-carboxamide is CCNC(=O)C1=CC(C)O1.
What is the InChIKey of N-ethyl-2-methyl-2H-oxete-4-carboxamide?
The InChIKey is VUDRXFCMKLATDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11NO2/c1-3-8-7(9)6-4-5(2)10-6/h4-5H,3H2,1-2H3,(H,8,9).
What are the key properties of N-ethyl-2-methyl-2H-oxete-4-carboxamide?
N-ethyl-2-methyl-2H-oxete-4-carboxamide has a molecular weight of 141.17 g/mol, XLogP of 0.43, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-methyl-2H-oxete-4-carboxamide is sourced from PubChem (CID 91411197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).