N-(2-morpholin-4-ium-4-ylethyl)thiophene-2-carboxamide

C11H17N2O2S+ — CID 6949050

IUPACN-(2-morpholin-4-ium-4-ylethyl)thiophene-2-carboxamide
SMILESO=C(NCC[NH+]1CCOCC1)c1cccs1
InChIInChI=1S/C11H16N2O2S/c14-11(10-2-1-9-16-10)12-3-4-13-5-7-15-8-6-13/h1-2,9H,3-8H2,(H,12,14)/p+1
InChIKeyLGBGZNHEADAJIV-UHFFFAOYSA-O
MW241.34 g/mol
LogP-0.61
Rot. Bonds4

About N-(2-morpholin-4-ium-4-ylethyl)thiophene-2-carboxamide

N-(2-morpholin-4-ium-4-ylethyl)thiophene-2-carboxamide (PubChem CID 6949050) has the molecular formula C11H17N2O2S+ and a molecular weight of 241.34 g/mol. Its IUPAC name is N-(2-morpholin-4-ium-4-ylethyl)thiophene-2-carboxamide.

Molecular Properties

Compound NameN-(2-morpholin-4-ium-4-ylethyl)thiophene-2-carboxamide
PubChem CID6949050
Molecular FormulaC11H17N2O2S+
Molecular Weight241.34 g/mol
Exact Mass241.10
IUPAC NameN-(2-morpholin-4-ium-4-ylethyl)thiophene-2-carboxamide
SMILESO=C(NCC[NH+]1CCOCC1)c1cccs1
InChIInChI=1S/C11H16N2O2S/c14-11(10-2-1-9-16-10)12-3-4-13-5-7-15-8-6-13/h1-2,9H,3-8H2,(H,12,14)/p+1
InChIKeyLGBGZNHEADAJIV-UHFFFAOYSA-O
XLogP-0.61
TPSA42.77 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 5-0.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-[4-(thiophene-2-carbonyl)piperazin-1-ium-1-yl]ethyl]thiophene-2-carboxamide
CID 4230629
N-(2-morpholin-4-ium-4-ylethyl)-4-thiophen-2-yloxane-4-carboxamide
CID 7243535
(E)-2-cyano-N-(2-morpholin-4-ium-4-ylethyl)-3-thiophen-2-ylprop-2-enamide
CID 2135288
N-(2-aminoethyl)thiophene-2-carboxamide
CID 4649097
N-[2-[[(1R)-1-(4-methylphenyl)-2-morpholin-4-ium-4-ylethyl]amino]-2-oxoethyl]thiophene-2-carboxamide
CID 9144588
3-chloro-N-(2-morpholin-4-ium-4-ylethyl)benzamide
CID 6919317
N-(2-cyanoethyl)thiophene-2-carboxamide
CID 60656092
N-[2-(carbamoylamino)ethyl]thiophene-2-carboxamide
CID 115282462
5-(4-methylphenyl)-N-(2-morpholin-4-ium-4-ylethyl)-1,2-oxazole-3-carboxamide
CID 6965930
N-(3-amino-3-oxopropyl)thiophene-2-carboxamide
CID 43236649
N-(2-morpholin-4-ium-4-ylethyl)-3,3-diphenylpropanamide
CID 6919320
N-[(4-thiophen-2-yloxan-4-yl)methyl]thiophene-2-carboxamide
CID 30943585

Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-ium-4-ylethyl)thiophene-2-carboxamide?
The IUPAC name of N-(2-morpholin-4-ium-4-ylethyl)thiophene-2-carboxamide (CID 6949050) is N-(2-morpholin-4-ium-4-ylethyl)thiophene-2-carboxamide.
What is the SMILES notation for N-(2-morpholin-4-ium-4-ylethyl)thiophene-2-carboxamide?
The canonical SMILES for N-(2-morpholin-4-ium-4-ylethyl)thiophene-2-carboxamide is O=C(NCC[NH+]1CCOCC1)c1cccs1.
What is the InChIKey of N-(2-morpholin-4-ium-4-ylethyl)thiophene-2-carboxamide?
The InChIKey is LGBGZNHEADAJIV-UHFFFAOYSA-O. The full InChI is InChI=1S/C11H16N2O2S/c14-11(10-2-1-9-16-10)12-3-4-13-5-7-15-8-6-13/h1-2,9H,3-8H2,(H,12,14)/p+1.
What are the key properties of N-(2-morpholin-4-ium-4-ylethyl)thiophene-2-carboxamide?
N-(2-morpholin-4-ium-4-ylethyl)thiophene-2-carboxamide has a molecular weight of 241.34 g/mol, XLogP of -0.61, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-ium-4-ylethyl)thiophene-2-carboxamide is sourced from PubChem (CID 6949050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).