N-(2-amino-4-ethoxycyclobutyl)-5-methylthiophene-2-carboxamide

C12H18N2O2S — CID 66195121

IUPACN-(2-amino-4-ethoxycyclobutyl)-5-methylthiophene-2-carboxamide
SMILESCCOC1CC(N)C1NC(=O)c1ccc(C)s1
InChIInChI=1S/C12H18N2O2S/c1-3-16-9-6-8(13)11(9)14-12(15)10-5-4-7(2)17-10/h4-5,8-9,11H,3,6,13H2,1-2H3,(H,14,15)
InChIKeyHBYSZXULMJKLFV-UHFFFAOYSA-N
MW254.35 g/mol
LogP1.29
Rot. Bonds4

About N-(2-amino-4-ethoxycyclobutyl)-5-methylthiophene-2-carboxamide

N-(2-amino-4-ethoxycyclobutyl)-5-methylthiophene-2-carboxamide (PubChem CID 66195121) has the molecular formula C12H18N2O2S and a molecular weight of 254.35 g/mol. Its IUPAC name is N-(2-amino-4-ethoxycyclobutyl)-5-methylthiophene-2-carboxamide.

Molecular Properties

Compound NameN-(2-amino-4-ethoxycyclobutyl)-5-methylthiophene-2-carboxamide
PubChem CID66195121
Molecular FormulaC12H18N2O2S
Molecular Weight254.35 g/mol
Exact Mass254.11
IUPAC NameN-(2-amino-4-ethoxycyclobutyl)-5-methylthiophene-2-carboxamide
SMILESCCOC1CC(N)C1NC(=O)c1ccc(C)s1
InChIInChI=1S/C12H18N2O2S/c1-3-16-9-6-8(13)11(9)14-12(15)10-5-4-7(2)17-10/h4-5,8-9,11H,3,6,13H2,1-2H3,(H,14,15)
InChIKeyHBYSZXULMJKLFV-UHFFFAOYSA-N
XLogP1.29
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.35
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-amino-4-ethoxycyclobutyl)-6-methyl-2-oxo-1H-pyridine-3-carboxamide
CID 104772875
N-(2-amino-4-ethoxycyclobutyl)-3-bromothiophene-2-carboxamide
CID 66196255
N-(2-amino-4-ethoxycyclobutyl)-2,4-dihydroxybenzamide
CID 66195669
N-(2-amino-4-ethoxycyclobutyl)-2-chlorofuran-3-carboxamide
CID 106688549
N-(2-amino-4-ethoxycyclobutyl)-2-bromo-4-chlorobenzamide
CID 107990557
N-[(3S,5R)-1-azatricyclo[3.3.1.13,7]decan-4-yl]-5-methylthiophene-2-carboxamide
CID 53234404
N-(2-amino-4-ethoxycyclobutyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
CID 66475604
N-(2-amino-4-ethoxycyclobutyl)-2-fluoro-4-nitrobenzamide
CID 66197224
ethyl N-[(5-methylthiophene-2-carbonyl)amino]carbamate
CID 30948448
1-(2-amino-4-ethoxycyclobutyl)-3-propylurea
CID 66197437
N-(2-amino-4-ethoxycyclobutyl)but-2-ynamide
CID 107990558
N-(2-amino-4-ethoxycyclobutyl)-3-ethoxypropanamide
CID 66197212

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-4-ethoxycyclobutyl)-5-methylthiophene-2-carboxamide?
The IUPAC name of N-(2-amino-4-ethoxycyclobutyl)-5-methylthiophene-2-carboxamide (CID 66195121) is N-(2-amino-4-ethoxycyclobutyl)-5-methylthiophene-2-carboxamide.
What is the SMILES notation for N-(2-amino-4-ethoxycyclobutyl)-5-methylthiophene-2-carboxamide?
The canonical SMILES for N-(2-amino-4-ethoxycyclobutyl)-5-methylthiophene-2-carboxamide is CCOC1CC(N)C1NC(=O)c1ccc(C)s1.
What is the InChIKey of N-(2-amino-4-ethoxycyclobutyl)-5-methylthiophene-2-carboxamide?
The InChIKey is HBYSZXULMJKLFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2S/c1-3-16-9-6-8(13)11(9)14-12(15)10-5-4-7(2)17-10/h4-5,8-9,11H,3,6,13H2,1-2H3,(H,14,15).
What are the key properties of N-(2-amino-4-ethoxycyclobutyl)-5-methylthiophene-2-carboxamide?
N-(2-amino-4-ethoxycyclobutyl)-5-methylthiophene-2-carboxamide has a molecular weight of 254.35 g/mol, XLogP of 1.29, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-4-ethoxycyclobutyl)-5-methylthiophene-2-carboxamide is sourced from PubChem (CID 66195121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).