N-cyclopropyl-2-[1-(2,5-dimethylthiophen-3-yl)ethylamino]-N-methylacetamide

C14H22N2OS — CID 54965170

IUPACN-cyclopropyl-2-[1-(2,5-dimethylthiophen-3-yl)ethylamino]-N-methylacetamide
SMILESCc1cc(C(C)NCC(=O)N(C)C2CC2)c(C)s1
InChIInChI=1S/C14H22N2OS/c1-9-7-13(11(3)18-9)10(2)15-8-14(17)16(4)12-5-6-12/h7,10,12,15H,5-6,8H2,1-4H3
InChIKeyYLUISWUWDIKKOX-UHFFFAOYSA-N
MW266.41 g/mol
LogP2.64
Rot. Bonds5

About N-cyclopropyl-2-[1-(2,5-dimethylthiophen-3-yl)ethylamino]-N-methylacetamide

N-cyclopropyl-2-[1-(2,5-dimethylthiophen-3-yl)ethylamino]-N-methylacetamide (PubChem CID 54965170) has the molecular formula C14H22N2OS and a molecular weight of 266.41 g/mol. Its IUPAC name is N-cyclopropyl-2-[1-(2,5-dimethylthiophen-3-yl)ethylamino]-N-methylacetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[1-(2,5-dimethylthiophen-3-yl)ethylamino]-N-methylacetamide
PubChem CID54965170
Molecular FormulaC14H22N2OS
Molecular Weight266.41 g/mol
Exact Mass266.15
IUPAC NameN-cyclopropyl-2-[1-(2,5-dimethylthiophen-3-yl)ethylamino]-N-methylacetamide
SMILESCc1cc(C(C)NCC(=O)N(C)C2CC2)c(C)s1
InChIInChI=1S/C14H22N2OS/c1-9-7-13(11(3)18-9)10(2)15-8-14(17)16(4)12-5-6-12/h7,10,12,15H,5-6,8H2,1-4H3
InChIKeyYLUISWUWDIKKOX-UHFFFAOYSA-N
XLogP2.64
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.41
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[1-(2,5-dimethylthiophen-3-yl)ethylamino]-N-methylacetamide?
The IUPAC name of N-cyclopropyl-2-[1-(2,5-dimethylthiophen-3-yl)ethylamino]-N-methylacetamide (CID 54965170) is N-cyclopropyl-2-[1-(2,5-dimethylthiophen-3-yl)ethylamino]-N-methylacetamide.
What is the SMILES notation for N-cyclopropyl-2-[1-(2,5-dimethylthiophen-3-yl)ethylamino]-N-methylacetamide?
The canonical SMILES for N-cyclopropyl-2-[1-(2,5-dimethylthiophen-3-yl)ethylamino]-N-methylacetamide is Cc1cc(C(C)NCC(=O)N(C)C2CC2)c(C)s1.
What is the InChIKey of N-cyclopropyl-2-[1-(2,5-dimethylthiophen-3-yl)ethylamino]-N-methylacetamide?
The InChIKey is YLUISWUWDIKKOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2OS/c1-9-7-13(11(3)18-9)10(2)15-8-14(17)16(4)12-5-6-12/h7,10,12,15H,5-6,8H2,1-4H3.
What are the key properties of N-cyclopropyl-2-[1-(2,5-dimethylthiophen-3-yl)ethylamino]-N-methylacetamide?
N-cyclopropyl-2-[1-(2,5-dimethylthiophen-3-yl)ethylamino]-N-methylacetamide has a molecular weight of 266.41 g/mol, XLogP of 2.64, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[1-(2,5-dimethylthiophen-3-yl)ethylamino]-N-methylacetamide is sourced from PubChem (CID 54965170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).