N-[(1-ethylpyrrolidin-2-yl)methyl]-3-methoxy-N,4-dimethylthiophene-2-carboxamide

C15H24N2O2S — CID 70365041

IUPACN-[(1-ethylpyrrolidin-2-yl)methyl]-3-methoxy-N,4-dimethylthiophene-2-carboxamide
SMILESCCN1CCCC1CN(C)C(=O)c1scc(C)c1OC
InChIInChI=1S/C15H24N2O2S/c1-5-17-8-6-7-12(17)9-16(3)15(18)14-13(19-4)11(2)10-20-14/h10,12H,5-9H2,1-4H3
InChIKeyMPWAFKNFXFOYKH-UHFFFAOYSA-N
MW296.44 g/mol
LogP2.62
Rot. Bonds5

About N-[(1-ethylpyrrolidin-2-yl)methyl]-3-methoxy-N,4-dimethylthiophene-2-carboxamide

N-[(1-ethylpyrrolidin-2-yl)methyl]-3-methoxy-N,4-dimethylthiophene-2-carboxamide (PubChem CID 70365041) has the molecular formula C15H24N2O2S and a molecular weight of 296.44 g/mol. Its IUPAC name is N-[(1-ethylpyrrolidin-2-yl)methyl]-3-methoxy-N,4-dimethylthiophene-2-carboxamide.

Molecular Properties

Compound NameN-[(1-ethylpyrrolidin-2-yl)methyl]-3-methoxy-N,4-dimethylthiophene-2-carboxamide
PubChem CID70365041
Molecular FormulaC15H24N2O2S
Molecular Weight296.44 g/mol
Exact Mass296.16
IUPAC NameN-[(1-ethylpyrrolidin-2-yl)methyl]-3-methoxy-N,4-dimethylthiophene-2-carboxamide
SMILESCCN1CCCC1CN(C)C(=O)c1scc(C)c1OC
InChIInChI=1S/C15H24N2O2S/c1-5-17-8-6-7-12(17)9-16(3)15(18)14-13(19-4)11(2)10-20-14/h10,12H,5-9H2,1-4H3
InChIKeyMPWAFKNFXFOYKH-UHFFFAOYSA-N
XLogP2.62
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.44
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(1-ethylpyrrolidin-2-yl)methyl]-3-hydroxy-4-methoxy-N-methylbenzamide
CID 79672225
3-N-[(1-ethylpyrrolidin-2-yl)methyl]-1-N,1-N,3-N-trimethylbenzene-1,3-dicarboxamide
CID 136511984
3-amino-N-[(1-ethylpyrrolidin-2-yl)methyl]-N-methyl-1H-1,2,4-triazole-5-carboxamide
CID 79314331
4-amino-3,5-dichloro-N-[(1-ethylpyrrolidin-2-yl)methyl]-N-methylbenzamide
CID 82813502
2-chloro-N-[(1-ethylpyrrolidin-2-yl)methyl]-5-hydroxy-N-methylbenzamide
CID 106501971
N-[(1-ethylpyrrolidin-2-yl)methyl]-N-methylpyrrolidine-1-carboxamide
CID 113248160
N-[(1-ethylpyrrolidin-2-yl)methyl]-N,2,2-trimethylpropanamide
CID 79312453
6-bromo-N-[(1-ethylpyrrolidin-2-yl)methyl]-N-methylpyridine-2-carboxamide
CID 103890012
6-chloro-N-[(1-ethylpyrrolidin-2-yl)methyl]-N-methylpyridine-2-carboxamide
CID 79313970
4-amino-1-ethyl-N-[(1-ethylpyrrolidin-2-yl)methyl]-N-methylpyrrole-2-carboxamide
CID 79303494
1-(3-bromo-2,6-dimethoxyphenyl)-N-[(1-ethylpyrrolidin-2-yl)methyl]-N-methylethenamine
CID 89080580
4-(aminomethyl)-N-[(1-ethylpyrrolidin-2-yl)methyl]-N-methylcyclohexane-1-carboxamide
CID 79313305

Frequently Asked Questions

What is the IUPAC name of N-[(1-ethylpyrrolidin-2-yl)methyl]-3-methoxy-N,4-dimethylthiophene-2-carboxamide?
The IUPAC name of N-[(1-ethylpyrrolidin-2-yl)methyl]-3-methoxy-N,4-dimethylthiophene-2-carboxamide (CID 70365041) is N-[(1-ethylpyrrolidin-2-yl)methyl]-3-methoxy-N,4-dimethylthiophene-2-carboxamide.
What is the SMILES notation for N-[(1-ethylpyrrolidin-2-yl)methyl]-3-methoxy-N,4-dimethylthiophene-2-carboxamide?
The canonical SMILES for N-[(1-ethylpyrrolidin-2-yl)methyl]-3-methoxy-N,4-dimethylthiophene-2-carboxamide is CCN1CCCC1CN(C)C(=O)c1scc(C)c1OC.
What is the InChIKey of N-[(1-ethylpyrrolidin-2-yl)methyl]-3-methoxy-N,4-dimethylthiophene-2-carboxamide?
The InChIKey is MPWAFKNFXFOYKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2S/c1-5-17-8-6-7-12(17)9-16(3)15(18)14-13(19-4)11(2)10-20-14/h10,12H,5-9H2,1-4H3.
What are the key properties of N-[(1-ethylpyrrolidin-2-yl)methyl]-3-methoxy-N,4-dimethylthiophene-2-carboxamide?
N-[(1-ethylpyrrolidin-2-yl)methyl]-3-methoxy-N,4-dimethylthiophene-2-carboxamide has a molecular weight of 296.44 g/mol, XLogP of 2.62, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-ethylpyrrolidin-2-yl)methyl]-3-methoxy-N,4-dimethylthiophene-2-carboxamide is sourced from PubChem (CID 70365041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).