N-methyl-1-(2-methylphenyl)-5-thiophen-2-ylpentan-2-amine

C17H23NS — CID 61065069

IUPACN-methyl-1-(2-methylphenyl)-5-thiophen-2-ylpentan-2-amine
SMILESCNC(CCCc1cccs1)Cc1ccccc1C
InChIInChI=1S/C17H23NS/c1-14-7-3-4-8-15(14)13-16(18-2)9-5-10-17-11-6-12-19-17/h3-4,6-8,11-12,16,18H,5,9-10,13H2,1-2H3
InChIKeyDKKFTGWTJGHNON-UHFFFAOYSA-N
MW273.44 g/mol
LogP4.21
Rot. Bonds7

About N-methyl-1-(2-methylphenyl)-5-thiophen-2-ylpentan-2-amine

N-methyl-1-(2-methylphenyl)-5-thiophen-2-ylpentan-2-amine (PubChem CID 61065069) has the molecular formula C17H23NS and a molecular weight of 273.44 g/mol. Its IUPAC name is N-methyl-1-(2-methylphenyl)-5-thiophen-2-ylpentan-2-amine.

Molecular Properties

Compound NameN-methyl-1-(2-methylphenyl)-5-thiophen-2-ylpentan-2-amine
PubChem CID61065069
Molecular FormulaC17H23NS
Molecular Weight273.44 g/mol
Exact Mass273.16
IUPAC NameN-methyl-1-(2-methylphenyl)-5-thiophen-2-ylpentan-2-amine
SMILESCNC(CCCc1cccs1)Cc1ccccc1C
InChIInChI=1S/C17H23NS/c1-14-7-3-4-8-15(14)13-16(18-2)9-5-10-17-11-6-12-19-17/h3-4,6-8,11-12,16,18H,5,9-10,13H2,1-2H3
InChIKeyDKKFTGWTJGHNON-UHFFFAOYSA-N
XLogP4.21
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.44
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-1-phenyl-6-thiophen-2-ylhexan-3-amine
CID 105094221
1-(2-chloro-3-fluorophenyl)-N-methyl-5-thiophen-2-ylpentan-2-amine
CID 105178932
1-(2-fluoro-3-methoxyphenyl)-N-methyl-5-thiophen-2-ylpentan-2-amine
CID 105180648
N,6-dimethyl-1-(2-methylphenyl)heptan-2-amine
CID 83161242
N-methyl-1-(2-methyl-1,3-thiazol-4-yl)-5-thiophen-2-ylpentan-2-amine
CID 105159077
1-(2-methylphenyl)-4-thiophen-2-ylbutan-2-amine
CID 63774241
N-methyl-1-(5-methyl-2-pyridinyl)-5-thiophen-2-ylpentan-2-amine
CID 66447519
N-methyl-1-(2-methylphenyl)octan-2-amine
CID 62605223
N-methyl-6-phenyl-1-thiophen-2-ylhexan-3-amine
CID 105150151
1-(3,4-dichlorophenyl)-N-methyl-5-thiophen-2-ylpentan-2-amine
CID 63527812
N-methyl-1-methylsulfonyl-7-thiophen-2-ylheptan-4-amine
CID 105113307
1-cyclopropyl-N-methyl-6-thiophen-2-ylhexan-3-amine
CID 105157838

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(2-methylphenyl)-5-thiophen-2-ylpentan-2-amine?
The IUPAC name of N-methyl-1-(2-methylphenyl)-5-thiophen-2-ylpentan-2-amine (CID 61065069) is N-methyl-1-(2-methylphenyl)-5-thiophen-2-ylpentan-2-amine.
What is the SMILES notation for N-methyl-1-(2-methylphenyl)-5-thiophen-2-ylpentan-2-amine?
The canonical SMILES for N-methyl-1-(2-methylphenyl)-5-thiophen-2-ylpentan-2-amine is CNC(CCCc1cccs1)Cc1ccccc1C.
What is the InChIKey of N-methyl-1-(2-methylphenyl)-5-thiophen-2-ylpentan-2-amine?
The InChIKey is DKKFTGWTJGHNON-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23NS/c1-14-7-3-4-8-15(14)13-16(18-2)9-5-10-17-11-6-12-19-17/h3-4,6-8,11-12,16,18H,5,9-10,13H2,1-2H3.
What are the key properties of N-methyl-1-(2-methylphenyl)-5-thiophen-2-ylpentan-2-amine?
N-methyl-1-(2-methylphenyl)-5-thiophen-2-ylpentan-2-amine has a molecular weight of 273.44 g/mol, XLogP of 4.21, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(2-methylphenyl)-5-thiophen-2-ylpentan-2-amine is sourced from PubChem (CID 61065069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).