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

C13H21NS — CID 107191644

IUPACN-methyl-1-(2-methylcyclopentyl)-1-(2-methylthiophen-3-yl)methanamine
SMILESCNC(c1ccsc1C)C1CCCC1C
InChIInChI=1S/C13H21NS/c1-9-5-4-6-11(9)13(14-3)12-7-8-15-10(12)2/h7-9,11,13-14H,4-6H2,1-3H3
InChIKeyFJRQEIVGNKVKEA-UHFFFAOYSA-N
MW223.38 g/mol
LogP3.75
Rot. Bonds3

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

N-methyl-1-(2-methylcyclopentyl)-1-(2-methylthiophen-3-yl)methanamine (PubChem CID 107191644) has the molecular formula C13H21NS and a molecular weight of 223.38 g/mol. Its IUPAC name is N-methyl-1-(2-methylcyclopentyl)-1-(2-methylthiophen-3-yl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(2-methylcyclopentyl)-1-(2-methylthiophen-3-yl)methanamine
PubChem CID107191644
Molecular FormulaC13H21NS
Molecular Weight223.38 g/mol
Exact Mass223.14
IUPAC NameN-methyl-1-(2-methylcyclopentyl)-1-(2-methylthiophen-3-yl)methanamine
SMILESCNC(c1ccsc1C)C1CCCC1C
InChIInChI=1S/C13H21NS/c1-9-5-4-6-11(9)13(14-3)12-7-8-15-10(12)2/h7-9,11,13-14H,4-6H2,1-3H3
InChIKeyFJRQEIVGNKVKEA-UHFFFAOYSA-N
XLogP3.75
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.38
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(6-bicyclo[3.1.0]hexanyl)-N-methyl-1-(2-methylthiophen-3-yl)methanamine
CID 102841672
1-cyclopentyl-N-methyl-1-(2-methylthiophen-3-yl)methanamine
CID 102832026
1-(7-bicyclo[4.1.0]heptanyl)-N-methyl-1-(2-methylthiophen-3-yl)methanamine
CID 102841400
N-methyl-1-(3-methyloxolan-2-yl)-1-(2-methylthiophen-3-yl)methanamine
CID 102840428
1-(1-benzothiophen-3-yl)-N-methyl-1-(2-methylcyclopentyl)methanamine
CID 107177277
N-methyl-1-(2-methylcyclopentyl)-1-(5-methylthiophen-2-yl)methanamine
CID 107177150
N-methyl-1-(2-methylcyclopentyl)-1-(5-methylthiophen-3-yl)methanamine
CID 107189272
N-[cyclobutyl-(2-methylthiophen-3-yl)methyl]ethanamine
CID 102832629
1-(4-bromo-5-methylthiophen-2-yl)-N-methyl-1-(2-methylcyclopentyl)methanamine
CID 107178270
N-methyl-1-(2-methylcyclopentyl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine
CID 107177156
(2-methylcyclopentyl)-(3-methylthiophen-2-yl)methanamine
CID 107177670
1-(3,4-dihydro-2H-pyran-6-yl)-N-methyl-1-(2-methylcyclopentyl)methanamine
CID 107191585

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(2-methylcyclopentyl)-1-(2-methylthiophen-3-yl)methanamine?
The IUPAC name of N-methyl-1-(2-methylcyclopentyl)-1-(2-methylthiophen-3-yl)methanamine (CID 107191644) is N-methyl-1-(2-methylcyclopentyl)-1-(2-methylthiophen-3-yl)methanamine.
What is the SMILES notation for N-methyl-1-(2-methylcyclopentyl)-1-(2-methylthiophen-3-yl)methanamine?
The canonical SMILES for N-methyl-1-(2-methylcyclopentyl)-1-(2-methylthiophen-3-yl)methanamine is CNC(c1ccsc1C)C1CCCC1C.
What is the InChIKey of N-methyl-1-(2-methylcyclopentyl)-1-(2-methylthiophen-3-yl)methanamine?
The InChIKey is FJRQEIVGNKVKEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NS/c1-9-5-4-6-11(9)13(14-3)12-7-8-15-10(12)2/h7-9,11,13-14H,4-6H2,1-3H3.
What are the key properties of N-methyl-1-(2-methylcyclopentyl)-1-(2-methylthiophen-3-yl)methanamine?
N-methyl-1-(2-methylcyclopentyl)-1-(2-methylthiophen-3-yl)methanamine has a molecular weight of 223.38 g/mol, XLogP of 3.75, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(2-methylcyclopentyl)-1-(2-methylthiophen-3-yl)methanamine is sourced from PubChem (CID 107191644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).