N-methyl-1-(2-methylcyclopentyl)-1-(5-methylthiophen-3-yl)methanamine

C13H21NS — CID 107189272

IUPACN-methyl-1-(2-methylcyclopentyl)-1-(5-methylthiophen-3-yl)methanamine
SMILESCNC(c1csc(C)c1)C1CCCC1C
InChIInChI=1S/C13H21NS/c1-9-5-4-6-12(9)13(14-3)11-7-10(2)15-8-11/h7-9,12-14H,4-6H2,1-3H3
InChIKeyJFADTBFYVHRXPY-UHFFFAOYSA-N
MW223.38 g/mol
LogP3.75
Rot. Bonds3

About N-methyl-1-(2-methylcyclopentyl)-1-(5-methylthiophen-3-yl)methanamine

N-methyl-1-(2-methylcyclopentyl)-1-(5-methylthiophen-3-yl)methanamine (PubChem CID 107189272) has the molecular formula C13H21NS and a molecular weight of 223.38 g/mol. Its IUPAC name is N-methyl-1-(2-methylcyclopentyl)-1-(5-methylthiophen-3-yl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(2-methylcyclopentyl)-1-(5-methylthiophen-3-yl)methanamine
PubChem CID107189272
Molecular FormulaC13H21NS
Molecular Weight223.38 g/mol
Exact Mass223.14
IUPAC NameN-methyl-1-(2-methylcyclopentyl)-1-(5-methylthiophen-3-yl)methanamine
SMILESCNC(c1csc(C)c1)C1CCCC1C
InChIInChI=1S/C13H21NS/c1-9-5-4-6-12(9)13(14-3)11-7-10(2)15-8-11/h7-9,12-14H,4-6H2,1-3H3
InChIKeyJFADTBFYVHRXPY-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

N-[(2-methylcyclopentyl)-(5-methylthiophen-3-yl)methyl]propan-1-amine
CID 107189268
1-cycloheptyl-N-methyl-1-(5-methylthiophen-3-yl)methanamine
CID 65399489
N-methyl-1-(3-methyloxolan-2-yl)-1-(5-methylthiophen-3-yl)methanamine
CID 104991316
N-methyl-1-(5-methyloxolan-2-yl)-1-(5-methylthiophen-3-yl)methanamine
CID 104991165
N-methyl-1-(2-methylcyclopentyl)-1-(2-methylthiophen-3-yl)methanamine
CID 107191644
N-methyl-1-(2-methylcyclopentyl)-1-(5-methylthiophen-2-yl)methanamine
CID 107177150
[cyclopentyl-(5-methylthiophen-3-yl)methyl]hydrazine
CID 105204481
1-(1-benzothiophen-3-yl)-N-methyl-1-(2-methylcyclopentyl)methanamine
CID 107177277
N-methyl-1-(2-methylcyclopentyl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine
CID 107177156
N-[(3-methyloxan-4-yl)-(5-methylthiophen-3-yl)methyl]ethanamine
CID 114241957
1-(4-bromo-5-methylthiophen-2-yl)-N-methyl-1-(2-methylcyclopentyl)methanamine
CID 107178270
1-(1,4-diazabicyclo[2.2.2]octan-2-yl)-N-methyl-1-(5-methylthiophen-3-yl)methanamine
CID 79974832

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(2-methylcyclopentyl)-1-(5-methylthiophen-3-yl)methanamine?
The IUPAC name of N-methyl-1-(2-methylcyclopentyl)-1-(5-methylthiophen-3-yl)methanamine (CID 107189272) is N-methyl-1-(2-methylcyclopentyl)-1-(5-methylthiophen-3-yl)methanamine.
What is the SMILES notation for N-methyl-1-(2-methylcyclopentyl)-1-(5-methylthiophen-3-yl)methanamine?
The canonical SMILES for N-methyl-1-(2-methylcyclopentyl)-1-(5-methylthiophen-3-yl)methanamine is CNC(c1csc(C)c1)C1CCCC1C.
What is the InChIKey of N-methyl-1-(2-methylcyclopentyl)-1-(5-methylthiophen-3-yl)methanamine?
The InChIKey is JFADTBFYVHRXPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NS/c1-9-5-4-6-12(9)13(14-3)11-7-10(2)15-8-11/h7-9,12-14H,4-6H2,1-3H3.
What are the key properties of N-methyl-1-(2-methylcyclopentyl)-1-(5-methylthiophen-3-yl)methanamine?
N-methyl-1-(2-methylcyclopentyl)-1-(5-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-(5-methylthiophen-3-yl)methanamine is sourced from PubChem (CID 107189272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).