2-methyl-N-[(2-methylthiophen-3-yl)methyl]propan-2-amine

C10H17NS — CID 102832538

IUPAC2-methyl-N-[(2-methylthiophen-3-yl)methyl]propan-2-amine
SMILESCc1sccc1CNC(C)(C)C
InChIInChI=1S/C10H17NS/c1-8-9(5-6-12-8)7-11-10(2,3)4/h5-6,11H,7H2,1-4H3
InChIKeyZEDQJSHOGPQMIT-UHFFFAOYSA-N
MW183.32 g/mol
LogP2.94
Rot. Bonds2

About 2-methyl-N-[(2-methylthiophen-3-yl)methyl]propan-2-amine

2-methyl-N-[(2-methylthiophen-3-yl)methyl]propan-2-amine (PubChem CID 102832538) has the molecular formula C10H17NS and a molecular weight of 183.32 g/mol. Its IUPAC name is 2-methyl-N-[(2-methylthiophen-3-yl)methyl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[(2-methylthiophen-3-yl)methyl]propan-2-amine
PubChem CID102832538
Molecular FormulaC10H17NS
Molecular Weight183.32 g/mol
Exact Mass183.11
IUPAC Name2-methyl-N-[(2-methylthiophen-3-yl)methyl]propan-2-amine
SMILESCc1sccc1CNC(C)(C)C
InChIInChI=1S/C10H17NS/c1-8-9(5-6-12-8)7-11-10(2,3)4/h5-6,11H,7H2,1-4H3
InChIKeyZEDQJSHOGPQMIT-UHFFFAOYSA-N
XLogP2.94
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.32
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2-bromothiophen-3-yl)methyl]-2-methylpropan-2-amine
CID 121367771
2-methyl-N-[3-(2-methylthiophen-3-yl)propyl]propan-2-amine
CID 102837741
N-[(2-methylthiophen-3-yl)methyl]pyridin-2-amine
CID 130671938
3-methyl-N-[(2-methylthiophen-3-yl)methyl]cyclobutan-1-amine
CID 130581294
N-[(2-cyclopropylphenyl)methyl]-2-methylpropan-2-amine
CID 79888960
3,3-difluoro-N-[(2-methylthiophen-3-yl)methyl]cyclobutan-1-amine
CID 131204148
N-[(2,4-dimethylphenyl)methyl]-2-methylpropan-2-amine
CID 16774947
N-[(2,3-dimethylphenyl)methyl]-2-methylpropan-2-amine
CID 60760457
2-(2-methylthiophen-3-yl)ethanol
CID 13144701
2-(2-methylthiophen-3-yl)acetic acid
CID 768693
N-[[4-[(tert-butylamino)methyl]phenyl]methyl]-2-methylpropan-2-amine
CID 22251747
N-[(5-chloro-2-fluorophenyl)methyl]-2-methylpropan-2-amine
CID 60984555

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(2-methylthiophen-3-yl)methyl]propan-2-amine?
The IUPAC name of 2-methyl-N-[(2-methylthiophen-3-yl)methyl]propan-2-amine (CID 102832538) is 2-methyl-N-[(2-methylthiophen-3-yl)methyl]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[(2-methylthiophen-3-yl)methyl]propan-2-amine?
The canonical SMILES for 2-methyl-N-[(2-methylthiophen-3-yl)methyl]propan-2-amine is Cc1sccc1CNC(C)(C)C.
What is the InChIKey of 2-methyl-N-[(2-methylthiophen-3-yl)methyl]propan-2-amine?
The InChIKey is ZEDQJSHOGPQMIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NS/c1-8-9(5-6-12-8)7-11-10(2,3)4/h5-6,11H,7H2,1-4H3.
What are the key properties of 2-methyl-N-[(2-methylthiophen-3-yl)methyl]propan-2-amine?
2-methyl-N-[(2-methylthiophen-3-yl)methyl]propan-2-amine has a molecular weight of 183.32 g/mol, XLogP of 2.94, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(2-methylthiophen-3-yl)methyl]propan-2-amine is sourced from PubChem (CID 102832538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).