N-[2-(dimethylamino)ethyl]-N-ethyl-3-thiophen-2-ylpropanamide

C13H22N2OS — CID 70852374

IUPACN-[2-(dimethylamino)ethyl]-N-ethyl-3-thiophen-2-ylpropanamide
SMILESCCN(CCN(C)C)C(=O)CCc1cccs1
InChIInChI=1S/C13H22N2OS/c1-4-15(10-9-14(2)3)13(16)8-7-12-6-5-11-17-12/h5-6,11H,4,7-10H2,1-3H3
InChIKeySDWKAMGKANZFJF-UHFFFAOYSA-N
MW254.40 g/mol
LogP2.09
Rot. Bonds7

About N-[2-(dimethylamino)ethyl]-N-ethyl-3-thiophen-2-ylpropanamide

N-[2-(dimethylamino)ethyl]-N-ethyl-3-thiophen-2-ylpropanamide (PubChem CID 70852374) has the molecular formula C13H22N2OS and a molecular weight of 254.40 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-N-ethyl-3-thiophen-2-ylpropanamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-N-ethyl-3-thiophen-2-ylpropanamide
PubChem CID70852374
Molecular FormulaC13H22N2OS
Molecular Weight254.40 g/mol
Exact Mass254.15
IUPAC NameN-[2-(dimethylamino)ethyl]-N-ethyl-3-thiophen-2-ylpropanamide
SMILESCCN(CCN(C)C)C(=O)CCc1cccs1
InChIInChI=1S/C13H22N2OS/c1-4-15(10-9-14(2)3)13(16)8-7-12-6-5-11-17-12/h5-6,11H,4,7-10H2,1-3H3
InChIKeySDWKAMGKANZFJF-UHFFFAOYSA-N
XLogP2.09
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.40
LogP ≤ 52.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-3-thiophen-2-yl-N-(thiophen-2-ylmethyl)propanamide
CID 78801832
3-amino-N-ethyl-N-(2-thiophen-2-ylethyl)propanamide;hydrochloride
CID 119292705
N-[(2-chlorophenyl)methyl]-N-ethyl-3-thiophen-2-ylpropanamide
CID 52572631
N-methyl-3-thiophen-2-yl-N-(thiophen-2-ylmethyl)propanamide
CID 110733634
N-ethyl-N-(2-hydroxyethyl)-2-thiophen-2-ylacetamide
CID 39243285
3-[ethyl-[methyl(2-thiophen-2-ylethyl)carbamoyl]amino]propanoic acid
CID 79487712
N-methyl-3-sulfanyl-N-(2-thiophen-2-ylethyl)propanamide
CID 107032192
2-[2-(dimethylamino)ethyl-(thiophen-2-ylmethyl)amino]acetic acid
CID 107425908
N,N-dimethyl-2-thiophen-2-ylethanamine;hydrochloride
CID 19760547
N-ethyl-4-oxo-4-thiophen-2-yl-N-(thiophen-2-ylmethyl)butanamide
CID 78801765
ethyl 2-[methyl(3-thiophen-2-ylpropanoyl)amino]acetate
CID 55003743
1,3-diethyl-1-methyl-3-(thiophen-2-ylmethyl)urea
CID 116654591

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-N-ethyl-3-thiophen-2-ylpropanamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-N-ethyl-3-thiophen-2-ylpropanamide (CID 70852374) is N-[2-(dimethylamino)ethyl]-N-ethyl-3-thiophen-2-ylpropanamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-N-ethyl-3-thiophen-2-ylpropanamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-N-ethyl-3-thiophen-2-ylpropanamide is CCN(CCN(C)C)C(=O)CCc1cccs1.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-N-ethyl-3-thiophen-2-ylpropanamide?
The InChIKey is SDWKAMGKANZFJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2OS/c1-4-15(10-9-14(2)3)13(16)8-7-12-6-5-11-17-12/h5-6,11H,4,7-10H2,1-3H3.
What are the key properties of N-[2-(dimethylamino)ethyl]-N-ethyl-3-thiophen-2-ylpropanamide?
N-[2-(dimethylamino)ethyl]-N-ethyl-3-thiophen-2-ylpropanamide has a molecular weight of 254.40 g/mol, XLogP of 2.09, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-N-ethyl-3-thiophen-2-ylpropanamide is sourced from PubChem (CID 70852374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).