5-(5-methyl-1-propan-2-ylbenzimidazol-2-yl)thiophen-2-amine

C15H17N3S — CID 54919687

IUPAC5-(5-methyl-1-propan-2-ylbenzimidazol-2-yl)thiophen-2-amine
SMILESCc1ccc2c(c1)nc(-c1ccc(N)s1)n2C(C)C
InChIInChI=1S/C15H17N3S/c1-9(2)18-12-5-4-10(3)8-11(12)17-15(18)13-6-7-14(16)19-13/h4-9H,16H2,1-3H3
InChIKeySNXNVEOTUZNVQX-UHFFFAOYSA-N
MW271.39 g/mol
LogP4.24
Rot. Bonds2

About 5-(5-methyl-1-propan-2-ylbenzimidazol-2-yl)thiophen-2-amine

5-(5-methyl-1-propan-2-ylbenzimidazol-2-yl)thiophen-2-amine (PubChem CID 54919687) has the molecular formula C15H17N3S and a molecular weight of 271.39 g/mol. Its IUPAC name is 5-(5-methyl-1-propan-2-ylbenzimidazol-2-yl)thiophen-2-amine.

Molecular Properties

Compound Name5-(5-methyl-1-propan-2-ylbenzimidazol-2-yl)thiophen-2-amine
PubChem CID54919687
Molecular FormulaC15H17N3S
Molecular Weight271.39 g/mol
Exact Mass271.11
IUPAC Name5-(5-methyl-1-propan-2-ylbenzimidazol-2-yl)thiophen-2-amine
SMILESCc1ccc2c(c1)nc(-c1ccc(N)s1)n2C(C)C
InChIInChI=1S/C15H17N3S/c1-9(2)18-12-5-4-10(3)8-11(12)17-15(18)13-6-7-14(16)19-13/h4-9H,16H2,1-3H3
InChIKeySNXNVEOTUZNVQX-UHFFFAOYSA-N
XLogP4.24
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.39
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(2-Benzothiazolyl)-3-ethyl-2-[2-(methylphenylamino)ethenyl]-1-phenyl-1H-benzimidazolium iodide
CID 5719375
2-(5-{4-[Amino(imino)methyl]phenyl}-2-thienyl)-1H-benzimidazole-6-carboximidamide dihydrochloride
CID 449090
N-[(E)-2-[5-(1,3-benzothiazol-2-yl)-3-ethyl-1-phenylbenzimidazol-3-ium-2-yl]ethenyl]-N-methylaniline
CID 2326992
1-Methyl-2-thiophen-2-ylbenzimidazole
CID 931177
1-Isopropyl-2-thiophen-2-yl-1H-benzoimidazole
CID 949166
6-Thiophen-2-yl-6,12-dihydrobenzimidazolo[1,2-c]quinazoline
CID 3818611
4-{[4-(thiophen-3-yl)-1H-imidazol-1-yl]methyl}aniline
CID 6539902
7-Methyl-2-(thiophen-2'-yl)-1H-benzo[d]imidazole (11)
CID 60646299
1,3-dimethyl-2-(2-thienyl)-1H-3,1-benzimidazol-3-ium chloride
CID 2866315
1-(prop-2-en-1-yl)-2-(thiophen-2-yl)-1H-1,3-benzodiazole
CID 962267
1-[(2-methylphenyl)methyl]-2-(thiophen-2-yl)-1H-1,3-benzodiazole
CID 962311
N-{4-[2-(Dimethylamino)-1-(1H-imidazol-1-yl)propyl]phenyl}-1,3-benzothiazol-2-amine
CID 9842708

Frequently Asked Questions

What is the IUPAC name of 5-(5-methyl-1-propan-2-ylbenzimidazol-2-yl)thiophen-2-amine?
The IUPAC name of 5-(5-methyl-1-propan-2-ylbenzimidazol-2-yl)thiophen-2-amine (CID 54919687) is 5-(5-methyl-1-propan-2-ylbenzimidazol-2-yl)thiophen-2-amine.
What is the SMILES notation for 5-(5-methyl-1-propan-2-ylbenzimidazol-2-yl)thiophen-2-amine?
The canonical SMILES for 5-(5-methyl-1-propan-2-ylbenzimidazol-2-yl)thiophen-2-amine is Cc1ccc2c(c1)nc(-c1ccc(N)s1)n2C(C)C.
What is the InChIKey of 5-(5-methyl-1-propan-2-ylbenzimidazol-2-yl)thiophen-2-amine?
The InChIKey is SNXNVEOTUZNVQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3S/c1-9(2)18-12-5-4-10(3)8-11(12)17-15(18)13-6-7-14(16)19-13/h4-9H,16H2,1-3H3.
What are the key properties of 5-(5-methyl-1-propan-2-ylbenzimidazol-2-yl)thiophen-2-amine?
5-(5-methyl-1-propan-2-ylbenzimidazol-2-yl)thiophen-2-amine has a molecular weight of 271.39 g/mol, XLogP of 4.24, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-methyl-1-propan-2-ylbenzimidazol-2-yl)thiophen-2-amine is sourced from PubChem (CID 54919687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).