N-ethyl-2-methyloxolane-3-carboxamide

C8H15NO2 — CID 79758522

IUPACN-ethyl-2-methyloxolane-3-carboxamide
SMILESCCNC(=O)C1CCOC1C
InChIInChI=1S/C8H15NO2/c1-3-9-8(10)7-4-5-11-6(7)2/h6-7H,3-5H2,1-2H3,(H,9,10)
InChIKeyLBHYITWRLDFRER-UHFFFAOYSA-N
MW157.21 g/mol
LogP0.55
Rot. Bonds2

About N-ethyl-2-methyloxolane-3-carboxamide

N-ethyl-2-methyloxolane-3-carboxamide (PubChem CID 79758522) has the molecular formula C8H15NO2 and a molecular weight of 157.21 g/mol. Its IUPAC name is N-ethyl-2-methyloxolane-3-carboxamide.

Molecular Properties

Compound NameN-ethyl-2-methyloxolane-3-carboxamide
PubChem CID79758522
Molecular FormulaC8H15NO2
Molecular Weight157.21 g/mol
Exact Mass157.11
IUPAC NameN-ethyl-2-methyloxolane-3-carboxamide
SMILESCCNC(=O)C1CCOC1C
InChIInChI=1S/C8H15NO2/c1-3-9-8(10)7-4-5-11-6(7)2/h6-7H,3-5H2,1-2H3,(H,9,10)
InChIKeyLBHYITWRLDFRER-UHFFFAOYSA-N
XLogP0.55
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.21
LogP ≤ 50.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(2-methyloxolane-3-carbonyl)amino]acetic acid
CID 79750229
2-methyl-N-prop-2-ynyloxolane-3-carboxamide
CID 79762562
2-[[(2-methyloxolane-3-carbonyl)amino]methyl]pentanoic acid
CID 79758556
N-[(4-bromocyclohexyl)methyl]-2-methyloxolane-3-carboxamide
CID 106134904
2-methyl-N-(2-oxo-2-piperazin-1-ylethyl)oxolane-3-carboxamide
CID 79760319
2-methyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]oxolane-3-carboxamide
CID 104971935
methyl 2-iodo-3-[(2-methyloxolane-3-carbonyl)amino]propanoate
CID 103493206
2-methyl-N-pent-4-ynyloxolane-3-carboxamide
CID 103894078
N-[2-(2-bromoethyl)pentyl]-2-methyloxolane-3-carboxamide
CID 106118030
N-[(2-chlorocyclopentyl)methyl]-2-methyloxolane-3-carboxamide
CID 114303020
N-[(4-hydroxyphenyl)methyl]-2-methyloxolane-3-carboxamide
CID 113347521
(3R)-2-methyloxolane-3-carboxylic acid
CID 54532975

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-methyloxolane-3-carboxamide?
The IUPAC name of N-ethyl-2-methyloxolane-3-carboxamide (CID 79758522) is N-ethyl-2-methyloxolane-3-carboxamide.
What is the SMILES notation for N-ethyl-2-methyloxolane-3-carboxamide?
The canonical SMILES for N-ethyl-2-methyloxolane-3-carboxamide is CCNC(=O)C1CCOC1C.
What is the InChIKey of N-ethyl-2-methyloxolane-3-carboxamide?
The InChIKey is LBHYITWRLDFRER-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO2/c1-3-9-8(10)7-4-5-11-6(7)2/h6-7H,3-5H2,1-2H3,(H,9,10).
What are the key properties of N-ethyl-2-methyloxolane-3-carboxamide?
N-ethyl-2-methyloxolane-3-carboxamide has a molecular weight of 157.21 g/mol, XLogP of 0.55, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-methyloxolane-3-carboxamide is sourced from PubChem (CID 79758522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).