N-[2-(diethylamino)ethyl]thiophene-3-carboxamide

C11H18N2OS — CID 47007987

IUPACN-[2-(diethylamino)ethyl]thiophene-3-carboxamide
SMILESCCN(CC)CCNC(=O)c1ccsc1
InChIInChI=1S/C11H18N2OS/c1-3-13(4-2)7-6-12-11(14)10-5-8-15-9-10/h5,8-9H,3-4,6-7H2,1-2H3,(H,12,14)
InChIKeyUBWPHZDRIRHTKB-UHFFFAOYSA-N
MW226.34 g/mol
LogP1.82
Rot. Bonds6

About N-[2-(diethylamino)ethyl]thiophene-3-carboxamide

N-[2-(diethylamino)ethyl]thiophene-3-carboxamide (PubChem CID 47007987) has the molecular formula C11H18N2OS and a molecular weight of 226.34 g/mol. Its IUPAC name is N-[2-(diethylamino)ethyl]thiophene-3-carboxamide.

Molecular Properties

Compound NameN-[2-(diethylamino)ethyl]thiophene-3-carboxamide
PubChem CID47007987
Molecular FormulaC11H18N2OS
Molecular Weight226.34 g/mol
Exact Mass226.11
IUPAC NameN-[2-(diethylamino)ethyl]thiophene-3-carboxamide
SMILESCCN(CC)CCNC(=O)c1ccsc1
InChIInChI=1S/C11H18N2OS/c1-3-13(4-2)7-6-12-11(14)10-5-8-15-9-10/h5,8-9H,3-4,6-7H2,1-2H3,(H,12,14)
InChIKeyUBWPHZDRIRHTKB-UHFFFAOYSA-N
XLogP1.82
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.34
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(thiophene-3-carbonylamino)ethyl]thiophene-3-carboxamide
CID 101004058
N-[2-[[(2S)-butan-2-yl]-methylamino]ethyl]thiophene-3-carboxamide
CID 95167795
N-[2-(propylamino)ethyl]thiophene-3-carboxamide
CID 62658821
N-[[2-(diethylaminomethyl)phenyl]methyl]thiophene-3-carboxamide
CID 134022174
4-tert-butyl-N-[2-(diethylamino)ethyl]benzamide
CID 19165344
N-[2-(diethylamino)ethyl]-4-(dimethylamino)benzamide
CID 47101000
4-amino-N-[2-(diethylamino)ethyl]benzamide;copper;hydrochloride
CID 70426685
N-[2-(diethylamino)ethyl]-4-(trifluoromethyl)benzamide
CID 3327071
1-N,4-N-bis[3-(diethylamino)propyl]benzene-1,4-dicarboxamide
CID 2842708
methyl 2-[propyl-[3-(thiophene-3-carbonylamino)propanoyl]amino]acetate
CID 61224315
N-(4-hydroxypentyl)thiophene-3-carboxamide
CID 107299586
N-[3-[methoxy(methyl)amino]-3-oxopropyl]thiophene-3-carboxamide
CID 60656257

Frequently Asked Questions

What is the IUPAC name of N-[2-(diethylamino)ethyl]thiophene-3-carboxamide?
The IUPAC name of N-[2-(diethylamino)ethyl]thiophene-3-carboxamide (CID 47007987) is N-[2-(diethylamino)ethyl]thiophene-3-carboxamide.
What is the SMILES notation for N-[2-(diethylamino)ethyl]thiophene-3-carboxamide?
The canonical SMILES for N-[2-(diethylamino)ethyl]thiophene-3-carboxamide is CCN(CC)CCNC(=O)c1ccsc1.
What is the InChIKey of N-[2-(diethylamino)ethyl]thiophene-3-carboxamide?
The InChIKey is UBWPHZDRIRHTKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2OS/c1-3-13(4-2)7-6-12-11(14)10-5-8-15-9-10/h5,8-9H,3-4,6-7H2,1-2H3,(H,12,14).
What are the key properties of N-[2-(diethylamino)ethyl]thiophene-3-carboxamide?
N-[2-(diethylamino)ethyl]thiophene-3-carboxamide has a molecular weight of 226.34 g/mol, XLogP of 1.82, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(diethylamino)ethyl]thiophene-3-carboxamide is sourced from PubChem (CID 47007987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).