N-cyclopropyl-4-methyl-1-(2-thiophen-2-ylethyl)imidazol-2-amine

C13H17N3S — CID 106559095

IUPACN-cyclopropyl-4-methyl-1-(2-thiophen-2-ylethyl)imidazol-2-amine
SMILESCc1cn(CCc2cccs2)c(NC2CC2)n1
InChIInChI=1S/C13H17N3S/c1-10-9-16(7-6-12-3-2-8-17-12)13(14-10)15-11-4-5-11/h2-3,8-9,11H,4-7H2,1H3,(H,14,15)
InChIKeyNKUKGJZGBRKGAC-UHFFFAOYSA-N
MW247.37 g/mol
LogP3.07
Rot. Bonds5

About N-cyclopropyl-4-methyl-1-(2-thiophen-2-ylethyl)imidazol-2-amine

N-cyclopropyl-4-methyl-1-(2-thiophen-2-ylethyl)imidazol-2-amine (PubChem CID 106559095) has the molecular formula C13H17N3S and a molecular weight of 247.37 g/mol. Its IUPAC name is N-cyclopropyl-4-methyl-1-(2-thiophen-2-ylethyl)imidazol-2-amine.

Molecular Properties

Compound NameN-cyclopropyl-4-methyl-1-(2-thiophen-2-ylethyl)imidazol-2-amine
PubChem CID106559095
Molecular FormulaC13H17N3S
Molecular Weight247.37 g/mol
Exact Mass247.11
IUPAC NameN-cyclopropyl-4-methyl-1-(2-thiophen-2-ylethyl)imidazol-2-amine
SMILESCc1cn(CCc2cccs2)c(NC2CC2)n1
InChIInChI=1S/C13H17N3S/c1-10-9-16(7-6-12-3-2-8-17-12)13(14-10)15-11-4-5-11/h2-3,8-9,11H,4-7H2,1H3,(H,14,15)
InChIKeyNKUKGJZGBRKGAC-UHFFFAOYSA-N
XLogP3.07
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.37
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclohexyl-4-methyl-1-[2-(2-methylpyrazol-3-yl)ethyl]imidazol-2-amine
CID 106583003
1-(2-methoxyethyl)-4-methyl-N-(4-methylcyclohexyl)imidazol-2-amine
CID 106560145
N-cyclopropyl-1-(3-methoxypropyl)-4-methylimidazol-2-amine
CID 106554952
1-[(5-chlorothiophen-2-yl)methyl]-N-cyclopropyl-4-methylimidazol-2-amine
CID 106575435
N-cyclooctyl-4-methyl-1-propylimidazol-2-amine
CID 106557173
N-cyclopentyl-4-methyl-1-(3-methylsulfinylpropyl)imidazol-2-amine
CID 106580537
N-cyclopropyl-4-methyl-1-(2-methylpropyl)imidazol-2-amine
CID 106554938
N-cyclopropyl-4-methyl-1-[2-(triazol-1-yl)ethyl]imidazol-2-amine
CID 106579724
N-cyclopropyl-4-methyl-1-(thian-4-ylmethyl)imidazol-2-amine
CID 106580084
4-methyl-N-(3-methylcyclopentyl)-1-propylimidazol-2-amine
CID 106581853
N-cyclopentyl-4-methyl-1-(2-pyrazol-1-ylethyl)imidazol-2-amine
CID 106568575
N-cyclopropyl-4-methyl-1-(pyridin-3-ylmethyl)imidazol-2-amine
CID 106560493

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-4-methyl-1-(2-thiophen-2-ylethyl)imidazol-2-amine?
The IUPAC name of N-cyclopropyl-4-methyl-1-(2-thiophen-2-ylethyl)imidazol-2-amine (CID 106559095) is N-cyclopropyl-4-methyl-1-(2-thiophen-2-ylethyl)imidazol-2-amine.
What is the SMILES notation for N-cyclopropyl-4-methyl-1-(2-thiophen-2-ylethyl)imidazol-2-amine?
The canonical SMILES for N-cyclopropyl-4-methyl-1-(2-thiophen-2-ylethyl)imidazol-2-amine is Cc1cn(CCc2cccs2)c(NC2CC2)n1.
What is the InChIKey of N-cyclopropyl-4-methyl-1-(2-thiophen-2-ylethyl)imidazol-2-amine?
The InChIKey is NKUKGJZGBRKGAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3S/c1-10-9-16(7-6-12-3-2-8-17-12)13(14-10)15-11-4-5-11/h2-3,8-9,11H,4-7H2,1H3,(H,14,15).
What are the key properties of N-cyclopropyl-4-methyl-1-(2-thiophen-2-ylethyl)imidazol-2-amine?
N-cyclopropyl-4-methyl-1-(2-thiophen-2-ylethyl)imidazol-2-amine has a molecular weight of 247.37 g/mol, XLogP of 3.07, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-4-methyl-1-(2-thiophen-2-ylethyl)imidazol-2-amine is sourced from PubChem (CID 106559095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).