N-methyl-1-(1-methylcyclopropyl)-1-(2-methylthiophen-3-yl)methanamine

C11H17NS — CID 102833419

IUPACN-methyl-1-(1-methylcyclopropyl)-1-(2-methylthiophen-3-yl)methanamine
SMILESCNC(c1ccsc1C)C1(C)CC1
InChIInChI=1S/C11H17NS/c1-8-9(4-7-13-8)10(12-3)11(2)5-6-11/h4,7,10,12H,5-6H2,1-3H3
InChIKeyBRIRSGIFCVHASQ-UHFFFAOYSA-N
MW195.33 g/mol
LogP3.12
Rot. Bonds3

About N-methyl-1-(1-methylcyclopropyl)-1-(2-methylthiophen-3-yl)methanamine

N-methyl-1-(1-methylcyclopropyl)-1-(2-methylthiophen-3-yl)methanamine (PubChem CID 102833419) has the molecular formula C11H17NS and a molecular weight of 195.33 g/mol. Its IUPAC name is N-methyl-1-(1-methylcyclopropyl)-1-(2-methylthiophen-3-yl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(1-methylcyclopropyl)-1-(2-methylthiophen-3-yl)methanamine
PubChem CID102833419
Molecular FormulaC11H17NS
Molecular Weight195.33 g/mol
Exact Mass195.11
IUPAC NameN-methyl-1-(1-methylcyclopropyl)-1-(2-methylthiophen-3-yl)methanamine
SMILESCNC(c1ccsc1C)C1(C)CC1
InChIInChI=1S/C11H17NS/c1-8-9(4-7-13-8)10(12-3)11(2)5-6-11/h4,7,10,12H,5-6H2,1-3H3
InChIKeyBRIRSGIFCVHASQ-UHFFFAOYSA-N
XLogP3.12
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.33
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1-methoxy-4,4-dimethylcyclohexyl)-(2-methylthiophen-3-yl)methyl]ethanamine
CID 102834015
[(2-methylthiophen-3-yl)-(1-piperidin-1-ylcyclopentyl)methyl]hydrazine
CID 102842888
1-cyclopentyl-N-methyl-1-(2-methylthiophen-3-yl)methanamine
CID 102832026
N-methyl-1-(1-methylcyclohexyl)-1-(2-methylphenyl)methanamine
CID 106829818
1-(2-fluoro-5-methylphenyl)-N-methyl-1-(1-methylcyclohexyl)methanamine
CID 106830046
(4,4-dimethylcyclohexyl)-(2-methylthiophen-3-yl)methanol
CID 102831356
N-[(1-ethoxycycloheptyl)-(2-methylthiophen-3-yl)methyl]propan-1-amine
CID 102834029
1-(6-bicyclo[3.1.0]hexanyl)-N-methyl-1-(2-methylthiophen-3-yl)methanamine
CID 102841672
1-(7-bicyclo[4.1.0]heptanyl)-N-methyl-1-(2-methylthiophen-3-yl)methanamine
CID 102841400
N-methyl-1-(2-methylthiophen-3-yl)butan-1-amine
CID 102831979
N-methyl-1-(2-methylthiophen-3-yl)-1-(3-methylthiophen-2-yl)methanamine
CID 102841226
1-(4-fluoro-2-methylphenyl)-N-methyl-1-(1-methylcyclopentyl)methanamine
CID 115852569

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(1-methylcyclopropyl)-1-(2-methylthiophen-3-yl)methanamine?
The IUPAC name of N-methyl-1-(1-methylcyclopropyl)-1-(2-methylthiophen-3-yl)methanamine (CID 102833419) is N-methyl-1-(1-methylcyclopropyl)-1-(2-methylthiophen-3-yl)methanamine.
What is the SMILES notation for N-methyl-1-(1-methylcyclopropyl)-1-(2-methylthiophen-3-yl)methanamine?
The canonical SMILES for N-methyl-1-(1-methylcyclopropyl)-1-(2-methylthiophen-3-yl)methanamine is CNC(c1ccsc1C)C1(C)CC1.
What is the InChIKey of N-methyl-1-(1-methylcyclopropyl)-1-(2-methylthiophen-3-yl)methanamine?
The InChIKey is BRIRSGIFCVHASQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NS/c1-8-9(4-7-13-8)10(12-3)11(2)5-6-11/h4,7,10,12H,5-6H2,1-3H3.
What are the key properties of N-methyl-1-(1-methylcyclopropyl)-1-(2-methylthiophen-3-yl)methanamine?
N-methyl-1-(1-methylcyclopropyl)-1-(2-methylthiophen-3-yl)methanamine has a molecular weight of 195.33 g/mol, XLogP of 3.12, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(1-methylcyclopropyl)-1-(2-methylthiophen-3-yl)methanamine is sourced from PubChem (CID 102833419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).