N-cyclopropyl-2-[(4,5-dimethylthiophen-2-yl)methylamino]-N-ethylacetamide

C14H22N2OS — CID 65244209

IUPACN-cyclopropyl-2-[(4,5-dimethylthiophen-2-yl)methylamino]-N-ethylacetamide
SMILESCCN(C(=O)CNCc1cc(C)c(C)s1)C1CC1
InChIInChI=1S/C14H22N2OS/c1-4-16(12-5-6-12)14(17)9-15-8-13-7-10(2)11(3)18-13/h7,12,15H,4-6,8-9H2,1-3H3
InChIKeyYAUMWYIHYHOMEG-UHFFFAOYSA-N
MW266.41 g/mol
LogP2.47
Rot. Bonds6

About N-cyclopropyl-2-[(4,5-dimethylthiophen-2-yl)methylamino]-N-ethylacetamide

N-cyclopropyl-2-[(4,5-dimethylthiophen-2-yl)methylamino]-N-ethylacetamide (PubChem CID 65244209) has the molecular formula C14H22N2OS and a molecular weight of 266.41 g/mol. Its IUPAC name is N-cyclopropyl-2-[(4,5-dimethylthiophen-2-yl)methylamino]-N-ethylacetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[(4,5-dimethylthiophen-2-yl)methylamino]-N-ethylacetamide
PubChem CID65244209
Molecular FormulaC14H22N2OS
Molecular Weight266.41 g/mol
Exact Mass266.15
IUPAC NameN-cyclopropyl-2-[(4,5-dimethylthiophen-2-yl)methylamino]-N-ethylacetamide
SMILESCCN(C(=O)CNCc1cc(C)c(C)s1)C1CC1
InChIInChI=1S/C14H22N2OS/c1-4-16(12-5-6-12)14(17)9-15-8-13-7-10(2)11(3)18-13/h7,12,15H,4-6,8-9H2,1-3H3
InChIKeyYAUMWYIHYHOMEG-UHFFFAOYSA-N
XLogP2.47
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.41
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(4,5-dimethylthiophen-2-yl)methylamino]-N-ethylacetamide
CID 65244076
N-cyclopropyl-N-ethyl-2-[(5-methyl-1,2,4-oxadiazol-3-yl)methylamino]acetamide
CID 114183707
N-cyclopropyl-N-ethyl-2-[(2-oxo-3H-1,3-thiazol-4-yl)methylamino]acetamide
CID 106380848
2-[[2-[cyclopropyl(ethyl)amino]-2-oxoethyl]amino]acetic acid
CID 43465978
N-cyclopropyl-2-(cyclopropylmethylamino)-N-ethylacetamide
CID 60843358
N-cyclopropyl-N-ethyl-2-(3-methylbutylamino)acetamide
CID 60975211
2-[(5-bromo-4-methylthiophen-2-yl)methylamino]-N,N-dimethylacetamide
CID 115710447
N-[(4,5-dimethylthiophen-2-yl)methyl]-2-(propylamino)acetamide
CID 65241174
N-cyclopropyl-2-(2,5-dichloro-4-methylanilino)-N-ethylacetamide
CID 115755804
N-[(4,5-dimethylthiophen-2-yl)methyl]-2-methylpropan-1-amine
CID 65238696
N-cyclohexyl-N-ethyl-2-(ethylamino)acetamide
CID 60686638
3-[[2-[cyclopropyl(ethyl)amino]-2-oxoethyl]amino]-N,N-diethylpropanamide
CID 112685323

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[(4,5-dimethylthiophen-2-yl)methylamino]-N-ethylacetamide?
The IUPAC name of N-cyclopropyl-2-[(4,5-dimethylthiophen-2-yl)methylamino]-N-ethylacetamide (CID 65244209) is N-cyclopropyl-2-[(4,5-dimethylthiophen-2-yl)methylamino]-N-ethylacetamide.
What is the SMILES notation for N-cyclopropyl-2-[(4,5-dimethylthiophen-2-yl)methylamino]-N-ethylacetamide?
The canonical SMILES for N-cyclopropyl-2-[(4,5-dimethylthiophen-2-yl)methylamino]-N-ethylacetamide is CCN(C(=O)CNCc1cc(C)c(C)s1)C1CC1.
What is the InChIKey of N-cyclopropyl-2-[(4,5-dimethylthiophen-2-yl)methylamino]-N-ethylacetamide?
The InChIKey is YAUMWYIHYHOMEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2OS/c1-4-16(12-5-6-12)14(17)9-15-8-13-7-10(2)11(3)18-13/h7,12,15H,4-6,8-9H2,1-3H3.
What are the key properties of N-cyclopropyl-2-[(4,5-dimethylthiophen-2-yl)methylamino]-N-ethylacetamide?
N-cyclopropyl-2-[(4,5-dimethylthiophen-2-yl)methylamino]-N-ethylacetamide has a molecular weight of 266.41 g/mol, XLogP of 2.47, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[(4,5-dimethylthiophen-2-yl)methylamino]-N-ethylacetamide is sourced from PubChem (CID 65244209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).