5-(4-tert-butyl-2-methylphenyl)thiophen-2-amine

C15H19NS — CID 82479198

IUPAC5-(4-tert-butyl-2-methylphenyl)thiophen-2-amine
SMILESCc1cc(C(C)(C)C)ccc1-c1ccc(N)s1
InChIInChI=1S/C15H19NS/c1-10-9-11(15(2,3)4)5-6-12(10)13-7-8-14(16)17-13/h5-9H,16H2,1-4H3
InChIKeyAUIWGORLCPLGBS-UHFFFAOYSA-N
MW245.39 g/mol
LogP4.60
Rot. Bonds1

About 5-(4-tert-butyl-2-methylphenyl)thiophen-2-amine

5-(4-tert-butyl-2-methylphenyl)thiophen-2-amine (PubChem CID 82479198) has the molecular formula C15H19NS and a molecular weight of 245.39 g/mol. Its IUPAC name is 5-(4-tert-butyl-2-methylphenyl)thiophen-2-amine.

Molecular Properties

Compound Name5-(4-tert-butyl-2-methylphenyl)thiophen-2-amine
PubChem CID82479198
Molecular FormulaC15H19NS
Molecular Weight245.39 g/mol
Exact Mass245.12
IUPAC Name5-(4-tert-butyl-2-methylphenyl)thiophen-2-amine
SMILESCc1cc(C(C)(C)C)ccc1-c1ccc(N)s1
InChIInChI=1S/C15H19NS/c1-10-9-11(15(2,3)4)5-6-12(10)13-7-8-14(16)17-13/h5-9H,16H2,1-4H3
InChIKeyAUIWGORLCPLGBS-UHFFFAOYSA-N
XLogP4.60
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.39
LogP ≤ 54.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[5-[2-methyl-4-(trifluoromethyl)phenyl]thiophen-2-yl]methanamine
CID 102755456
4-(4-tert-butyl-2-methylphenyl)-2-methyl-1,3-thiazol-5-amine
CID 82484831
[5-(5-tert-butyl-2-methylphenyl)thiophen-2-yl]methanol
CID 82090304
5-tert-butyl-2-methylaniline
CID 13089979
5-(4-methoxy-2,3-dimethylphenyl)thiophen-2-amine
CID 82475633
3-(4-tert-butyl-2-methylphenyl)-1,2-oxazol-5-amine
CID 82474477
2-(4-tert-butyl-2-methylphenyl)-4-chloro-1,3-thiazole
CID 116892310
2-(2,4-dimethylphenyl)-5-ethylthiophene
CID 167264133
4-(5-tert-butyl-2-methylphenyl)-2-methyl-1,3-thiazol-5-amine
CID 82484825
5-(4-tert-butyl-2-methylphenyl)-1,2,4-triazin-3-amine
CID 82477837
[2-(4-tert-butyl-2-methylphenyl)-1,3-thiazol-4-yl]hydrazine
CID 116892119
[4-(4-tert-butyl-2-methylphenyl)-5-methylthiophen-3-yl]methanamine
CID 96669316

Frequently Asked Questions

What is the IUPAC name of 5-(4-tert-butyl-2-methylphenyl)thiophen-2-amine?
The IUPAC name of 5-(4-tert-butyl-2-methylphenyl)thiophen-2-amine (CID 82479198) is 5-(4-tert-butyl-2-methylphenyl)thiophen-2-amine.
What is the SMILES notation for 5-(4-tert-butyl-2-methylphenyl)thiophen-2-amine?
The canonical SMILES for 5-(4-tert-butyl-2-methylphenyl)thiophen-2-amine is Cc1cc(C(C)(C)C)ccc1-c1ccc(N)s1.
What is the InChIKey of 5-(4-tert-butyl-2-methylphenyl)thiophen-2-amine?
The InChIKey is AUIWGORLCPLGBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NS/c1-10-9-11(15(2,3)4)5-6-12(10)13-7-8-14(16)17-13/h5-9H,16H2,1-4H3.
What are the key properties of 5-(4-tert-butyl-2-methylphenyl)thiophen-2-amine?
5-(4-tert-butyl-2-methylphenyl)thiophen-2-amine has a molecular weight of 245.39 g/mol, XLogP of 4.60, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-tert-butyl-2-methylphenyl)thiophen-2-amine is sourced from PubChem (CID 82479198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).