1-(hydroxymethyl)-N-methyl-N-(3-methylthiophen-2-yl)cyclopropane-1-carboxamide

C11H15NO2S — CID 115182201

IUPAC1-(hydroxymethyl)-N-methyl-N-(3-methylthiophen-2-yl)cyclopropane-1-carboxamide
SMILESCc1ccsc1N(C)C(=O)C1(CO)CC1
InChIInChI=1S/C11H15NO2S/c1-8-3-6-15-9(8)12(2)10(14)11(7-13)4-5-11/h3,6,13H,4-5,7H2,1-2H3
InChIKeyOAPONMVKMGNAOE-UHFFFAOYSA-N
MW225.31 g/mol
LogP1.79
Rot. Bonds3

About 1-(hydroxymethyl)-N-methyl-N-(3-methylthiophen-2-yl)cyclopropane-1-carboxamide

1-(hydroxymethyl)-N-methyl-N-(3-methylthiophen-2-yl)cyclopropane-1-carboxamide (PubChem CID 115182201) has the molecular formula C11H15NO2S and a molecular weight of 225.31 g/mol. Its IUPAC name is 1-(hydroxymethyl)-N-methyl-N-(3-methylthiophen-2-yl)cyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-(hydroxymethyl)-N-methyl-N-(3-methylthiophen-2-yl)cyclopropane-1-carboxamide
PubChem CID115182201
Molecular FormulaC11H15NO2S
Molecular Weight225.31 g/mol
Exact Mass225.08
IUPAC Name1-(hydroxymethyl)-N-methyl-N-(3-methylthiophen-2-yl)cyclopropane-1-carboxamide
SMILESCc1ccsc1N(C)C(=O)C1(CO)CC1
InChIInChI=1S/C11H15NO2S/c1-8-3-6-15-9(8)12(2)10(14)11(7-13)4-5-11/h3,6,13H,4-5,7H2,1-2H3
InChIKeyOAPONMVKMGNAOE-UHFFFAOYSA-N
XLogP1.79
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.31
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-1-(methylaminomethyl)-N-(3-methylthiophen-2-yl)cyclobutane-1-carboxamide
CID 115183696
1-(hydroxymethyl)-N-methyl-N-thiophen-2-ylcyclobutane-1-carboxamide
CID 115183976
3-amino-1-methyl-1-(3-methylthiophen-2-yl)urea
CID 115192593
[3-(hydroxymethyl)oxetan-3-yl]-(3-methylthiophen-2-yl)methanone
CID 116922663
1-(hydroxymethyl)-N-methyl-N-(6-methyl-1,3-benzodioxol-5-yl)cyclopropane-1-carboxamide
CID 115182186
N-(2,5-dimethylphenyl)-1-(hydroxymethyl)-N-methylcyclobutane-1-carboxamide
CID 115183981
N-(3-bromophenyl)-1-(hydroxymethyl)-N-methylcyclopropane-1-carboxamide
CID 115182178
N-methyl-4-(methylamino)-N-(3-methylthiophen-2-yl)butanamide
CID 115155685
1-(hydroxymethyl)-N-methyl-N-[2-(2-methylphenyl)ethyl]cyclopropane-1-carboxamide
CID 115182456
3-amino-N-methyl-N-(3-methylthiophen-2-yl)butanamide
CID 115154152
1-(hydroxymethyl)-N-methyl-N-(2-methyl-1H-indol-3-yl)cyclopropane-1-carboxamide
CID 115182147
N-methyl-N-(3-methylthiophen-2-yl)pyrrolidine-2-carboxamide
CID 115159253

Frequently Asked Questions

What is the IUPAC name of 1-(hydroxymethyl)-N-methyl-N-(3-methylthiophen-2-yl)cyclopropane-1-carboxamide?
The IUPAC name of 1-(hydroxymethyl)-N-methyl-N-(3-methylthiophen-2-yl)cyclopropane-1-carboxamide (CID 115182201) is 1-(hydroxymethyl)-N-methyl-N-(3-methylthiophen-2-yl)cyclopropane-1-carboxamide.
What is the SMILES notation for 1-(hydroxymethyl)-N-methyl-N-(3-methylthiophen-2-yl)cyclopropane-1-carboxamide?
The canonical SMILES for 1-(hydroxymethyl)-N-methyl-N-(3-methylthiophen-2-yl)cyclopropane-1-carboxamide is Cc1ccsc1N(C)C(=O)C1(CO)CC1.
What is the InChIKey of 1-(hydroxymethyl)-N-methyl-N-(3-methylthiophen-2-yl)cyclopropane-1-carboxamide?
The InChIKey is OAPONMVKMGNAOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO2S/c1-8-3-6-15-9(8)12(2)10(14)11(7-13)4-5-11/h3,6,13H,4-5,7H2,1-2H3.
What are the key properties of 1-(hydroxymethyl)-N-methyl-N-(3-methylthiophen-2-yl)cyclopropane-1-carboxamide?
1-(hydroxymethyl)-N-methyl-N-(3-methylthiophen-2-yl)cyclopropane-1-carboxamide has a molecular weight of 225.31 g/mol, XLogP of 1.79, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(hydroxymethyl)-N-methyl-N-(3-methylthiophen-2-yl)cyclopropane-1-carboxamide is sourced from PubChem (CID 115182201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).