N-methyl-1-(2-thiophen-3-ylethyl)imidazol-2-amine

C10H13N3S — CID 106567511

IUPACN-methyl-1-(2-thiophen-3-ylethyl)imidazol-2-amine
SMILESCNc1nccn1CCc1ccsc1
InChIInChI=1S/C10H13N3S/c1-11-10-12-4-6-13(10)5-2-9-3-7-14-8-9/h3-4,6-8H,2,5H2,1H3,(H,11,12)
InChIKeyFMRUYCMSWAMXGN-UHFFFAOYSA-N
MW207.30 g/mol
LogP2.23
Rot. Bonds4

About N-methyl-1-(2-thiophen-3-ylethyl)imidazol-2-amine

N-methyl-1-(2-thiophen-3-ylethyl)imidazol-2-amine (PubChem CID 106567511) has the molecular formula C10H13N3S and a molecular weight of 207.30 g/mol. Its IUPAC name is N-methyl-1-(2-thiophen-3-ylethyl)imidazol-2-amine.

Molecular Properties

Compound NameN-methyl-1-(2-thiophen-3-ylethyl)imidazol-2-amine
PubChem CID106567511
Molecular FormulaC10H13N3S
Molecular Weight207.30 g/mol
Exact Mass207.08
IUPAC NameN-methyl-1-(2-thiophen-3-ylethyl)imidazol-2-amine
SMILESCNc1nccn1CCc1ccsc1
InChIInChI=1S/C10H13N3S/c1-11-10-12-4-6-13(10)5-2-9-3-7-14-8-9/h3-4,6-8H,2,5H2,1H3,(H,11,12)
InChIKeyFMRUYCMSWAMXGN-UHFFFAOYSA-N
XLogP2.23
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.30
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(2-thiophen-3-ylethyl)imidazol-2-amine?
The IUPAC name of N-methyl-1-(2-thiophen-3-ylethyl)imidazol-2-amine (CID 106567511) is N-methyl-1-(2-thiophen-3-ylethyl)imidazol-2-amine.
What is the SMILES notation for N-methyl-1-(2-thiophen-3-ylethyl)imidazol-2-amine?
The canonical SMILES for N-methyl-1-(2-thiophen-3-ylethyl)imidazol-2-amine is CNc1nccn1CCc1ccsc1.
What is the InChIKey of N-methyl-1-(2-thiophen-3-ylethyl)imidazol-2-amine?
The InChIKey is FMRUYCMSWAMXGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3S/c1-11-10-12-4-6-13(10)5-2-9-3-7-14-8-9/h3-4,6-8H,2,5H2,1H3,(H,11,12).
What are the key properties of N-methyl-1-(2-thiophen-3-ylethyl)imidazol-2-amine?
N-methyl-1-(2-thiophen-3-ylethyl)imidazol-2-amine has a molecular weight of 207.30 g/mol, XLogP of 2.23, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(2-thiophen-3-ylethyl)imidazol-2-amine is sourced from PubChem (CID 106567511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).