N-(5-chlorothiophen-2-yl)-N-methyl-1-(methylaminomethyl)cyclopropane-1-carboxamide

C11H15ClN2OS — CID 115182952

IUPACN-(5-chlorothiophen-2-yl)-N-methyl-1-(methylaminomethyl)cyclopropane-1-carboxamide
SMILESCNCC1(C(=O)N(C)c2ccc(Cl)s2)CC1
InChIInChI=1S/C11H15ClN2OS/c1-13-7-11(5-6-11)10(15)14(2)9-4-3-8(12)16-9/h3-4,13H,5-7H2,1-2H3
InChIKeyFCXPJJKIJGUOQD-UHFFFAOYSA-N
MW258.77 g/mol
LogP2.36
Rot. Bonds4

About N-(5-chlorothiophen-2-yl)-N-methyl-1-(methylaminomethyl)cyclopropane-1-carboxamide

N-(5-chlorothiophen-2-yl)-N-methyl-1-(methylaminomethyl)cyclopropane-1-carboxamide (PubChem CID 115182952) has the molecular formula C11H15ClN2OS and a molecular weight of 258.77 g/mol. Its IUPAC name is N-(5-chlorothiophen-2-yl)-N-methyl-1-(methylaminomethyl)cyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-(5-chlorothiophen-2-yl)-N-methyl-1-(methylaminomethyl)cyclopropane-1-carboxamide
PubChem CID115182952
Molecular FormulaC11H15ClN2OS
Molecular Weight258.77 g/mol
Exact Mass258.06
IUPAC NameN-(5-chlorothiophen-2-yl)-N-methyl-1-(methylaminomethyl)cyclopropane-1-carboxamide
SMILESCNCC1(C(=O)N(C)c2ccc(Cl)s2)CC1
InChIInChI=1S/C11H15ClN2OS/c1-13-7-11(5-6-11)10(15)14(2)9-4-3-8(12)16-9/h3-4,13H,5-7H2,1-2H3
InChIKeyFCXPJJKIJGUOQD-UHFFFAOYSA-N
XLogP2.36
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.77
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-bromophenyl)-N-methyl-1-(methylaminomethyl)cyclopropane-1-carboxamide
CID 115182941
1-[[(5-chlorothiophen-2-yl)-methylamino]methyl]cyclopropane-1-carboxylic acid
CID 115242816
N-methyl-1-(methylaminomethyl)-N-(2,3,4-trimethylphenyl)cyclopropane-1-carboxamide
CID 115182984
N-methyl-1-(methylaminomethyl)-N-(3-methylthiophen-2-yl)cyclobutane-1-carboxamide
CID 115183696
N-(2,3-dihydro-1H-inden-5-yl)-N-methyl-1-(methylaminomethyl)cyclopropane-1-carboxamide
CID 115182949
3-amino-1-(5-chlorothiophen-2-yl)-1-methylurea
CID 115192475
N-(3-methoxyphenyl)-N-methyl-1-(methylaminomethyl)cyclopropane-1-carboxamide
CID 115182981
N-(5-bromo-2-fluorophenyl)-N-methyl-1-(methylaminomethyl)cyclopropane-1-carboxamide
CID 115182970
N-tert-butyl-N-methyl-1-(methylaminomethyl)cyclopropane-1-carboxamide
CID 115182931
N'-(5-chlorothiophen-2-yl)-N,N'-dimethylmethanediamine
CID 115226650
N-[(2-fluorophenyl)methyl]-N-methyl-1-(methylaminomethyl)cyclopropane-1-carboxamide
CID 115183079
2-amino-N-(5-chlorothiophen-2-yl)-3-hydroxy-N-methylpropanamide
CID 115179707

Frequently Asked Questions

What is the IUPAC name of N-(5-chlorothiophen-2-yl)-N-methyl-1-(methylaminomethyl)cyclopropane-1-carboxamide?
The IUPAC name of N-(5-chlorothiophen-2-yl)-N-methyl-1-(methylaminomethyl)cyclopropane-1-carboxamide (CID 115182952) is N-(5-chlorothiophen-2-yl)-N-methyl-1-(methylaminomethyl)cyclopropane-1-carboxamide.
What is the SMILES notation for N-(5-chlorothiophen-2-yl)-N-methyl-1-(methylaminomethyl)cyclopropane-1-carboxamide?
The canonical SMILES for N-(5-chlorothiophen-2-yl)-N-methyl-1-(methylaminomethyl)cyclopropane-1-carboxamide is CNCC1(C(=O)N(C)c2ccc(Cl)s2)CC1.
What is the InChIKey of N-(5-chlorothiophen-2-yl)-N-methyl-1-(methylaminomethyl)cyclopropane-1-carboxamide?
The InChIKey is FCXPJJKIJGUOQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15ClN2OS/c1-13-7-11(5-6-11)10(15)14(2)9-4-3-8(12)16-9/h3-4,13H,5-7H2,1-2H3.
What are the key properties of N-(5-chlorothiophen-2-yl)-N-methyl-1-(methylaminomethyl)cyclopropane-1-carboxamide?
N-(5-chlorothiophen-2-yl)-N-methyl-1-(methylaminomethyl)cyclopropane-1-carboxamide has a molecular weight of 258.77 g/mol, XLogP of 2.36, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chlorothiophen-2-yl)-N-methyl-1-(methylaminomethyl)cyclopropane-1-carboxamide is sourced from PubChem (CID 115182952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).