N-(2-amino-2-methylpropyl)-2-(5-methylthiophen-2-yl)acetamide

C11H18N2OS — CID 119626700

IUPACN-(2-amino-2-methylpropyl)-2-(5-methylthiophen-2-yl)acetamide
SMILESCc1ccc(CC(=O)NCC(C)(C)N)s1
InChIInChI=1S/C11H18N2OS/c1-8-4-5-9(15-8)6-10(14)13-7-11(2,3)12/h4-5H,6-7,12H2,1-3H3,(H,13,14)
InChIKeyQUMWQSFIBMCKEB-UHFFFAOYSA-N
MW226.34 g/mol
LogP1.45
Rot. Bonds4

About N-(2-amino-2-methylpropyl)-2-(5-methylthiophen-2-yl)acetamide

N-(2-amino-2-methylpropyl)-2-(5-methylthiophen-2-yl)acetamide (PubChem CID 119626700) has the molecular formula C11H18N2OS and a molecular weight of 226.34 g/mol. Its IUPAC name is N-(2-amino-2-methylpropyl)-2-(5-methylthiophen-2-yl)acetamide.

Molecular Properties

Compound NameN-(2-amino-2-methylpropyl)-2-(5-methylthiophen-2-yl)acetamide
PubChem CID119626700
Molecular FormulaC11H18N2OS
Molecular Weight226.34 g/mol
Exact Mass226.11
IUPAC NameN-(2-amino-2-methylpropyl)-2-(5-methylthiophen-2-yl)acetamide
SMILESCc1ccc(CC(=O)NCC(C)(C)N)s1
InChIInChI=1S/C11H18N2OS/c1-8-4-5-9(15-8)6-10(14)13-7-11(2,3)12/h4-5H,6-7,12H2,1-3H3,(H,13,14)
InChIKeyQUMWQSFIBMCKEB-UHFFFAOYSA-N
XLogP1.45
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.34
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(5-methylthiophen-2-yl)acetohydrazide
CID 130978061
(2S)-3,3-dimethyl-2-[[2-(5-methylthiophen-2-yl)acetyl]amino]butanoic acid
CID 97324192
4-methyl-4-[[2-(5-methylthiophen-2-yl)acetyl]amino]pentanoic acid
CID 119204231
2-methyl-1-N-[(5-methylthiophen-2-yl)methyl]propane-1,2-diamine
CID 62056560
N-(2-amino-2-methylpropyl)-2-(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)acetamide
CID 119627872
6-[[2-(5-methylthiophen-2-yl)acetyl]amino]hexanoic acid
CID 119220034
N-[2-amino-2-(4-propan-2-ylphenyl)ethyl]-2-(5-methylthiophen-2-yl)acetamide;hydrochloride
CID 119525724
2-(4-aminophenyl)-N-[(5-methylthiophen-2-yl)methyl]acetamide
CID 62055681
N-(2-aminocyclopropyl)-2-(5-methylthiophen-2-yl)acetamide;hydrochloride
CID 130693929
N-(2-aminoethyl)-2-[[2-(5-methylthiophen-2-yl)acetyl]amino]benzamide;hydrochloride
CID 120604324
N-[2-(4-fluorophenyl)-2-hydroxyethyl]-2-(5-methylthiophen-2-yl)acetamide
CID 110921883
3-amino-2,2-dimethyl-N-[(5-methylthiophen-2-yl)methyl]propanamide
CID 81489224

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-methylpropyl)-2-(5-methylthiophen-2-yl)acetamide?
The IUPAC name of N-(2-amino-2-methylpropyl)-2-(5-methylthiophen-2-yl)acetamide (CID 119626700) is N-(2-amino-2-methylpropyl)-2-(5-methylthiophen-2-yl)acetamide.
What is the SMILES notation for N-(2-amino-2-methylpropyl)-2-(5-methylthiophen-2-yl)acetamide?
The canonical SMILES for N-(2-amino-2-methylpropyl)-2-(5-methylthiophen-2-yl)acetamide is Cc1ccc(CC(=O)NCC(C)(C)N)s1.
What is the InChIKey of N-(2-amino-2-methylpropyl)-2-(5-methylthiophen-2-yl)acetamide?
The InChIKey is QUMWQSFIBMCKEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2OS/c1-8-4-5-9(15-8)6-10(14)13-7-11(2,3)12/h4-5H,6-7,12H2,1-3H3,(H,13,14).
What are the key properties of N-(2-amino-2-methylpropyl)-2-(5-methylthiophen-2-yl)acetamide?
N-(2-amino-2-methylpropyl)-2-(5-methylthiophen-2-yl)acetamide has a molecular weight of 226.34 g/mol, XLogP of 1.45, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-methylpropyl)-2-(5-methylthiophen-2-yl)acetamide is sourced from PubChem (CID 119626700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).