N-ethyl-4-methyl-1-(thiophen-3-ylmethyl)imidazol-2-amine

C11H15N3S — CID 106571948

IUPACN-ethyl-4-methyl-1-(thiophen-3-ylmethyl)imidazol-2-amine
SMILESCCNc1nc(C)cn1Cc1ccsc1
InChIInChI=1S/C11H15N3S/c1-3-12-11-13-9(2)6-14(11)7-10-4-5-15-8-10/h4-6,8H,3,7H2,1-2H3,(H,12,13)
InChIKeyXWWCAZMUUOHUQB-UHFFFAOYSA-N
MW221.33 g/mol
LogP2.73
Rot. Bonds4

About N-ethyl-4-methyl-1-(thiophen-3-ylmethyl)imidazol-2-amine

N-ethyl-4-methyl-1-(thiophen-3-ylmethyl)imidazol-2-amine (PubChem CID 106571948) has the molecular formula C11H15N3S and a molecular weight of 221.33 g/mol. Its IUPAC name is N-ethyl-4-methyl-1-(thiophen-3-ylmethyl)imidazol-2-amine.

Molecular Properties

Compound NameN-ethyl-4-methyl-1-(thiophen-3-ylmethyl)imidazol-2-amine
PubChem CID106571948
Molecular FormulaC11H15N3S
Molecular Weight221.33 g/mol
Exact Mass221.10
IUPAC NameN-ethyl-4-methyl-1-(thiophen-3-ylmethyl)imidazol-2-amine
SMILESCCNc1nc(C)cn1Cc1ccsc1
InChIInChI=1S/C11H15N3S/c1-3-12-11-13-9(2)6-14(11)7-10-4-5-15-8-10/h4-6,8H,3,7H2,1-2H3,(H,12,13)
InChIKeyXWWCAZMUUOHUQB-UHFFFAOYSA-N
XLogP2.73
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.33
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-methoxyethyl)-4-methyl-N-(thiophen-3-ylmethyl)imidazol-2-amine
CID 106571951
N-ethyl-4-methyl-1-[(2-methylpyrazol-3-yl)methyl]imidazol-2-amine
CID 106573703
1-(2,2-dimethylpropyl)-N-ethyl-4-methylimidazol-2-amine
CID 106563656
N-ethyl-1-(2-thiophen-3-ylethyl)imidazol-2-amine
CID 106567554
4-methyl-1-phenyl-N-(2-thiophen-3-ylethyl)imidazol-2-amine
CID 106567558
N-ethyl-4-methyl-1-(2-methylsulfinylethyl)imidazol-2-amine
CID 106581380
N-(1-methoxypropan-2-yl)-4-methyl-1-(2-thiophen-3-ylethyl)imidazol-2-amine
CID 106567535
4-methyl-1-propyl-N-(1-thiophen-3-ylethyl)imidazol-2-amine
CID 106570913
N,4-dimethyl-1-(1,3-thiazol-4-ylmethyl)imidazol-2-amine
CID 106572508
N-ethyl-4-methyl-1-(2-methylsulfinylpropyl)imidazol-2-amine
CID 106581055
1-[(3-fluorophenyl)methyl]-4-methyl-N-(2-methylpropyl)imidazol-2-amine
CID 106560953
1-ethyl-4-methyl-N-(2-methylpropyl)imidazol-2-amine
CID 106554987

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-methyl-1-(thiophen-3-ylmethyl)imidazol-2-amine?
The IUPAC name of N-ethyl-4-methyl-1-(thiophen-3-ylmethyl)imidazol-2-amine (CID 106571948) is N-ethyl-4-methyl-1-(thiophen-3-ylmethyl)imidazol-2-amine.
What is the SMILES notation for N-ethyl-4-methyl-1-(thiophen-3-ylmethyl)imidazol-2-amine?
The canonical SMILES for N-ethyl-4-methyl-1-(thiophen-3-ylmethyl)imidazol-2-amine is CCNc1nc(C)cn1Cc1ccsc1.
What is the InChIKey of N-ethyl-4-methyl-1-(thiophen-3-ylmethyl)imidazol-2-amine?
The InChIKey is XWWCAZMUUOHUQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3S/c1-3-12-11-13-9(2)6-14(11)7-10-4-5-15-8-10/h4-6,8H,3,7H2,1-2H3,(H,12,13).
What are the key properties of N-ethyl-4-methyl-1-(thiophen-3-ylmethyl)imidazol-2-amine?
N-ethyl-4-methyl-1-(thiophen-3-ylmethyl)imidazol-2-amine has a molecular weight of 221.33 g/mol, XLogP of 2.73, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-methyl-1-(thiophen-3-ylmethyl)imidazol-2-amine is sourced from PubChem (CID 106571948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).