N-cyclopropyl-2-[1-(5-ethylthiophen-2-yl)ethylamino]acetamide

C13H20N2OS — CID 61333566

IUPACN-cyclopropyl-2-[1-(5-ethylthiophen-2-yl)ethylamino]acetamide
SMILESCCc1ccc(C(C)NCC(=O)NC2CC2)s1
InChIInChI=1S/C13H20N2OS/c1-3-11-6-7-12(17-11)9(2)14-8-13(16)15-10-4-5-10/h6-7,9-10,14H,3-5,8H2,1-2H3,(H,15,16)
InChIKeySFEYQJSSUADIKS-UHFFFAOYSA-N
MW252.38 g/mol
LogP2.24
Rot. Bonds6

About N-cyclopropyl-2-[1-(5-ethylthiophen-2-yl)ethylamino]acetamide

N-cyclopropyl-2-[1-(5-ethylthiophen-2-yl)ethylamino]acetamide (PubChem CID 61333566) has the molecular formula C13H20N2OS and a molecular weight of 252.38 g/mol. Its IUPAC name is N-cyclopropyl-2-[1-(5-ethylthiophen-2-yl)ethylamino]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[1-(5-ethylthiophen-2-yl)ethylamino]acetamide
PubChem CID61333566
Molecular FormulaC13H20N2OS
Molecular Weight252.38 g/mol
Exact Mass252.13
IUPAC NameN-cyclopropyl-2-[1-(5-ethylthiophen-2-yl)ethylamino]acetamide
SMILESCCc1ccc(C(C)NCC(=O)NC2CC2)s1
InChIInChI=1S/C13H20N2OS/c1-3-11-6-7-12(17-11)9(2)14-8-13(16)15-10-4-5-10/h6-7,9-10,14H,3-5,8H2,1-2H3,(H,15,16)
InChIKeySFEYQJSSUADIKS-UHFFFAOYSA-N
XLogP2.24
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.38
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[1-(5-ethylthiophen-2-yl)ethylamino]acetamide?
The IUPAC name of N-cyclopropyl-2-[1-(5-ethylthiophen-2-yl)ethylamino]acetamide (CID 61333566) is N-cyclopropyl-2-[1-(5-ethylthiophen-2-yl)ethylamino]acetamide.
What is the SMILES notation for N-cyclopropyl-2-[1-(5-ethylthiophen-2-yl)ethylamino]acetamide?
The canonical SMILES for N-cyclopropyl-2-[1-(5-ethylthiophen-2-yl)ethylamino]acetamide is CCc1ccc(C(C)NCC(=O)NC2CC2)s1.
What is the InChIKey of N-cyclopropyl-2-[1-(5-ethylthiophen-2-yl)ethylamino]acetamide?
The InChIKey is SFEYQJSSUADIKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2OS/c1-3-11-6-7-12(17-11)9(2)14-8-13(16)15-10-4-5-10/h6-7,9-10,14H,3-5,8H2,1-2H3,(H,15,16).
What are the key properties of N-cyclopropyl-2-[1-(5-ethylthiophen-2-yl)ethylamino]acetamide?
N-cyclopropyl-2-[1-(5-ethylthiophen-2-yl)ethylamino]acetamide has a molecular weight of 252.38 g/mol, XLogP of 2.24, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[1-(5-ethylthiophen-2-yl)ethylamino]acetamide is sourced from PubChem (CID 61333566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).