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

C14H24N2OS — CID 81296864

IUPACN-tert-butyl-2-[1-(5-ethylthiophen-2-yl)ethylamino]acetamide
SMILESCCc1ccc(C(C)NCC(=O)NC(C)(C)C)s1
InChIInChI=1S/C14H24N2OS/c1-6-11-7-8-12(18-11)10(2)15-9-13(17)16-14(3,4)5/h7-8,10,15H,6,9H2,1-5H3,(H,16,17)
InChIKeyTWBVFZHALLBKIM-UHFFFAOYSA-N
MW268.43 g/mol
LogP2.88
Rot. Bonds5

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

N-tert-butyl-2-[1-(5-ethylthiophen-2-yl)ethylamino]acetamide (PubChem CID 81296864) has the molecular formula C14H24N2OS and a molecular weight of 268.43 g/mol. Its IUPAC name is N-tert-butyl-2-[1-(5-ethylthiophen-2-yl)ethylamino]acetamide.

Molecular Properties

Compound NameN-tert-butyl-2-[1-(5-ethylthiophen-2-yl)ethylamino]acetamide
PubChem CID81296864
Molecular FormulaC14H24N2OS
Molecular Weight268.43 g/mol
Exact Mass268.16
IUPAC NameN-tert-butyl-2-[1-(5-ethylthiophen-2-yl)ethylamino]acetamide
SMILESCCc1ccc(C(C)NCC(=O)NC(C)(C)C)s1
InChIInChI=1S/C14H24N2OS/c1-6-11-7-8-12(18-11)10(2)15-9-13(17)16-14(3,4)5/h7-8,10,15H,6,9H2,1-5H3,(H,16,17)
InChIKeyTWBVFZHALLBKIM-UHFFFAOYSA-N
XLogP2.88
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.43
LogP ≤ 52.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[1-(5-bromothiophen-2-yl)ethylamino]-N-tert-butylacetamide
CID 81296450
N-cyclopropyl-2-[1-(5-ethylthiophen-2-yl)ethylamino]acetamide
CID 61333566
N-[2-[1-(5-ethylthiophen-2-yl)ethylamino]ethyl]acetamide
CID 61333178
3-[1-(5-ethylthiophen-2-yl)ethylamino]propanamide
CID 61333187
2-[1-(5-ethylthiophen-2-yl)ethylamino]-2-methylpropanamide
CID 61336100
3-[1-(5-ethylthiophen-2-yl)ethylamino]-1-pyrrolidin-1-ylpropan-1-one
CID 61333174
(1R)-1-(5-ethylthiophen-2-yl)-N-methylethanamine
CID 55277214
N-tert-butyl-2-[[(1S)-1-phenylethyl]amino]acetamide
CID 28564730
4-[1-(5-ethylthiophen-2-yl)ethylamino]benzoic acid
CID 61333563
N-[1-(5-ethylthiophen-2-yl)ethyl]prop-2-en-1-amine
CID 61334719
N-tert-butyl-2-(1-thiophen-3-ylethylamino)acetamide
CID 62842048
2-[1-(5-ethylthiophen-2-yl)ethylamino]-N-methylpropanamide
CID 61464605

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-[1-(5-ethylthiophen-2-yl)ethylamino]acetamide?
The IUPAC name of N-tert-butyl-2-[1-(5-ethylthiophen-2-yl)ethylamino]acetamide (CID 81296864) is N-tert-butyl-2-[1-(5-ethylthiophen-2-yl)ethylamino]acetamide.
What is the SMILES notation for N-tert-butyl-2-[1-(5-ethylthiophen-2-yl)ethylamino]acetamide?
The canonical SMILES for N-tert-butyl-2-[1-(5-ethylthiophen-2-yl)ethylamino]acetamide is CCc1ccc(C(C)NCC(=O)NC(C)(C)C)s1.
What is the InChIKey of N-tert-butyl-2-[1-(5-ethylthiophen-2-yl)ethylamino]acetamide?
The InChIKey is TWBVFZHALLBKIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2OS/c1-6-11-7-8-12(18-11)10(2)15-9-13(17)16-14(3,4)5/h7-8,10,15H,6,9H2,1-5H3,(H,16,17).
What are the key properties of N-tert-butyl-2-[1-(5-ethylthiophen-2-yl)ethylamino]acetamide?
N-tert-butyl-2-[1-(5-ethylthiophen-2-yl)ethylamino]acetamide has a molecular weight of 268.43 g/mol, XLogP of 2.88, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-[1-(5-ethylthiophen-2-yl)ethylamino]acetamide is sourced from PubChem (CID 81296864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).