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

C13H19N3S — CID 106570913

IUPAC4-methyl-1-propyl-N-(1-thiophen-3-ylethyl)imidazol-2-amine
SMILESCCCn1cc(C)nc1NC(C)c1ccsc1
InChIInChI=1S/C13H19N3S/c1-4-6-16-8-10(2)14-13(16)15-11(3)12-5-7-17-9-12/h5,7-9,11H,4,6H2,1-3H3,(H,14,15)
InChIKeyQAHWWAPQJVPHIT-UHFFFAOYSA-N
MW249.38 g/mol
LogP3.84
Rot. Bonds5

About 4-methyl-1-propyl-N-(1-thiophen-3-ylethyl)imidazol-2-amine

4-methyl-1-propyl-N-(1-thiophen-3-ylethyl)imidazol-2-amine (PubChem CID 106570913) has the molecular formula C13H19N3S and a molecular weight of 249.38 g/mol. Its IUPAC name is 4-methyl-1-propyl-N-(1-thiophen-3-ylethyl)imidazol-2-amine.

Molecular Properties

Compound Name4-methyl-1-propyl-N-(1-thiophen-3-ylethyl)imidazol-2-amine
PubChem CID106570913
Molecular FormulaC13H19N3S
Molecular Weight249.38 g/mol
Exact Mass249.13
IUPAC Name4-methyl-1-propyl-N-(1-thiophen-3-ylethyl)imidazol-2-amine
SMILESCCCn1cc(C)nc1NC(C)c1ccsc1
InChIInChI=1S/C13H19N3S/c1-4-6-16-8-10(2)14-13(16)15-11(3)12-5-7-17-9-12/h5,7-9,11H,4,6H2,1-3H3,(H,14,15)
InChIKeyQAHWWAPQJVPHIT-UHFFFAOYSA-N
XLogP3.84
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.38
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(4-chlorophenyl)ethyl]-4-methyl-1-propylimidazol-2-amine
CID 106565809
1-cyclopentyl-4-methyl-N-(1-thiophen-3-ylethyl)imidazol-2-amine
CID 106570905
1-ethyl-N-(1-thiophen-3-ylethyl)imidazol-2-amine
CID 62842596
4-methyl-1-propyl-N-(1-thiophen-2-ylbutyl)imidazol-2-amine
CID 106565322
N-[1-(3-bromophenyl)ethyl]-1-butyl-4-methylimidazol-2-amine
CID 106564464
4-ethyl-N-(1-thiophen-3-ylethyl)-1,3-thiazol-2-amine
CID 62962097
2-methyl-6-N-propyl-4-N-(1-thiophen-3-ylethyl)pyrimidine-4,6-diamine
CID 80824404
4-methyl-N-(1-thiophen-3-ylethyl)-1,3-thiazol-2-amine
CID 62842792
N-(1-methoxypropan-2-yl)-4-methyl-1-(1-thiophen-3-ylethyl)imidazol-2-amine
CID 106570907
3-ethyl-N-(1-thiophen-3-ylethyl)-1,2,4-thiadiazol-5-amine
CID 65274547
1-methyl-N-(1-thiophen-3-ylethyl)pyrazol-4-amine
CID 62090667
4-methyl-6-propan-2-yl-N-(1-thiophen-3-ylethyl)pyrimidin-2-amine
CID 113491500

Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-propyl-N-(1-thiophen-3-ylethyl)imidazol-2-amine?
The IUPAC name of 4-methyl-1-propyl-N-(1-thiophen-3-ylethyl)imidazol-2-amine (CID 106570913) is 4-methyl-1-propyl-N-(1-thiophen-3-ylethyl)imidazol-2-amine.
What is the SMILES notation for 4-methyl-1-propyl-N-(1-thiophen-3-ylethyl)imidazol-2-amine?
The canonical SMILES for 4-methyl-1-propyl-N-(1-thiophen-3-ylethyl)imidazol-2-amine is CCCn1cc(C)nc1NC(C)c1ccsc1.
What is the InChIKey of 4-methyl-1-propyl-N-(1-thiophen-3-ylethyl)imidazol-2-amine?
The InChIKey is QAHWWAPQJVPHIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3S/c1-4-6-16-8-10(2)14-13(16)15-11(3)12-5-7-17-9-12/h5,7-9,11H,4,6H2,1-3H3,(H,14,15).
What are the key properties of 4-methyl-1-propyl-N-(1-thiophen-3-ylethyl)imidazol-2-amine?
4-methyl-1-propyl-N-(1-thiophen-3-ylethyl)imidazol-2-amine has a molecular weight of 249.38 g/mol, XLogP of 3.84, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-propyl-N-(1-thiophen-3-ylethyl)imidazol-2-amine is sourced from PubChem (CID 106570913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).