N-ethyl-4-(ethylamino)-N-(thiophen-2-ylmethyl)oxolane-3-carboxamide

C14H22N2O2S — CID 66257715

IUPACN-ethyl-4-(ethylamino)-N-(thiophen-2-ylmethyl)oxolane-3-carboxamide
SMILESCCNC1COCC1C(=O)N(CC)Cc1cccs1
InChIInChI=1S/C14H22N2O2S/c1-3-15-13-10-18-9-12(13)14(17)16(4-2)8-11-6-5-7-19-11/h5-7,12-13,15H,3-4,8-10H2,1-2H3
InChIKeyPZXBWFLXTYHBAF-UHFFFAOYSA-N
MW282.41 g/mol
LogP1.72
Rot. Bonds6

About N-ethyl-4-(ethylamino)-N-(thiophen-2-ylmethyl)oxolane-3-carboxamide

N-ethyl-4-(ethylamino)-N-(thiophen-2-ylmethyl)oxolane-3-carboxamide (PubChem CID 66257715) has the molecular formula C14H22N2O2S and a molecular weight of 282.41 g/mol. Its IUPAC name is N-ethyl-4-(ethylamino)-N-(thiophen-2-ylmethyl)oxolane-3-carboxamide.

Molecular Properties

Compound NameN-ethyl-4-(ethylamino)-N-(thiophen-2-ylmethyl)oxolane-3-carboxamide
PubChem CID66257715
Molecular FormulaC14H22N2O2S
Molecular Weight282.41 g/mol
Exact Mass282.14
IUPAC NameN-ethyl-4-(ethylamino)-N-(thiophen-2-ylmethyl)oxolane-3-carboxamide
SMILESCCNC1COCC1C(=O)N(CC)Cc1cccs1
InChIInChI=1S/C14H22N2O2S/c1-3-15-13-10-18-9-12(13)14(17)16(4-2)8-11-6-5-7-19-11/h5-7,12-13,15H,3-4,8-10H2,1-2H3
InChIKeyPZXBWFLXTYHBAF-UHFFFAOYSA-N
XLogP1.72
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.41
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-thiophen-2-ylethyl 4-(ethylamino)oxolane-3-carboxylate
CID 66247933
N-ethyl-2-methyl-N-(thiophen-2-ylmethyl)pyrrolidine-3-carboxamide
CID 79389328
N-ethyl-2-methyl-2-(methylamino)-N-(thiophen-2-ylmethyl)propanamide
CID 62848345
N-ethyl-4-(ethylamino)-N-(2-fluorophenyl)oxolane-3-carboxamide
CID 66257551
1-ethyl-3-(oxolan-3-yl)-1-(thiophen-2-ylmethyl)urea
CID 113322013
4-(ethylamino)-N-[(3-fluorophenyl)methyl]-N-methyloxolane-3-carboxamide
CID 66258659
3-[cyclopropyl-[ethyl(thiophen-2-ylmethyl)carbamoyl]amino]propanoic acid
CID 61437782
N-[(3,4-difluorophenyl)methyl]-4-(ethylamino)-N-methyloxolane-3-carboxamide
CID 66257909
[4-(ethylamino)oxolan-3-yl]-phenylmethanone
CID 116588048
N,N-diethyl-4-(methylamino)oxolane-3-carboxamide
CID 66265754
4-[[4-(ethylamino)oxolane-3-carbonyl]-methylamino]benzoic acid
CID 104698721
N-[(5-bromothiophen-3-yl)methyl]-4-(ethylamino)-N-methyloxolane-3-carboxamide
CID 66258717

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-(ethylamino)-N-(thiophen-2-ylmethyl)oxolane-3-carboxamide?
The IUPAC name of N-ethyl-4-(ethylamino)-N-(thiophen-2-ylmethyl)oxolane-3-carboxamide (CID 66257715) is N-ethyl-4-(ethylamino)-N-(thiophen-2-ylmethyl)oxolane-3-carboxamide.
What is the SMILES notation for N-ethyl-4-(ethylamino)-N-(thiophen-2-ylmethyl)oxolane-3-carboxamide?
The canonical SMILES for N-ethyl-4-(ethylamino)-N-(thiophen-2-ylmethyl)oxolane-3-carboxamide is CCNC1COCC1C(=O)N(CC)Cc1cccs1.
What is the InChIKey of N-ethyl-4-(ethylamino)-N-(thiophen-2-ylmethyl)oxolane-3-carboxamide?
The InChIKey is PZXBWFLXTYHBAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2S/c1-3-15-13-10-18-9-12(13)14(17)16(4-2)8-11-6-5-7-19-11/h5-7,12-13,15H,3-4,8-10H2,1-2H3.
What are the key properties of N-ethyl-4-(ethylamino)-N-(thiophen-2-ylmethyl)oxolane-3-carboxamide?
N-ethyl-4-(ethylamino)-N-(thiophen-2-ylmethyl)oxolane-3-carboxamide has a molecular weight of 282.41 g/mol, XLogP of 1.72, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-(ethylamino)-N-(thiophen-2-ylmethyl)oxolane-3-carboxamide is sourced from PubChem (CID 66257715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).