1-ethyl-N-(2-methoxypropyl)-4-methylimidazol-2-amine

C10H19N3O — CID 106583458

IUPAC1-ethyl-N-(2-methoxypropyl)-4-methylimidazol-2-amine
SMILESCCn1cc(C)nc1NCC(C)OC
InChIInChI=1S/C10H19N3O/c1-5-13-7-8(2)12-10(13)11-6-9(3)14-4/h7,9H,5-6H2,1-4H3,(H,11,12)
InChIKeyXVMVSVFSGMURST-UHFFFAOYSA-N
MW197.28 g/mol
LogP1.66
Rot. Bonds5

About 1-ethyl-N-(2-methoxypropyl)-4-methylimidazol-2-amine

1-ethyl-N-(2-methoxypropyl)-4-methylimidazol-2-amine (PubChem CID 106583458) has the molecular formula C10H19N3O and a molecular weight of 197.28 g/mol. Its IUPAC name is 1-ethyl-N-(2-methoxypropyl)-4-methylimidazol-2-amine.

Molecular Properties

Compound Name1-ethyl-N-(2-methoxypropyl)-4-methylimidazol-2-amine
PubChem CID106583458
Molecular FormulaC10H19N3O
Molecular Weight197.28 g/mol
Exact Mass197.15
IUPAC Name1-ethyl-N-(2-methoxypropyl)-4-methylimidazol-2-amine
SMILESCCn1cc(C)nc1NCC(C)OC
InChIInChI=1S/C10H19N3O/c1-5-13-7-8(2)12-10(13)11-6-9(3)14-4/h7,9H,5-6H2,1-4H3,(H,11,12)
InChIKeyXVMVSVFSGMURST-UHFFFAOYSA-N
XLogP1.66
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-(2-methoxypropyl)-4-methylimidazol-2-amine?
The IUPAC name of 1-ethyl-N-(2-methoxypropyl)-4-methylimidazol-2-amine (CID 106583458) is 1-ethyl-N-(2-methoxypropyl)-4-methylimidazol-2-amine.
What is the SMILES notation for 1-ethyl-N-(2-methoxypropyl)-4-methylimidazol-2-amine?
The canonical SMILES for 1-ethyl-N-(2-methoxypropyl)-4-methylimidazol-2-amine is CCn1cc(C)nc1NCC(C)OC.
What is the InChIKey of 1-ethyl-N-(2-methoxypropyl)-4-methylimidazol-2-amine?
The InChIKey is XVMVSVFSGMURST-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O/c1-5-13-7-8(2)12-10(13)11-6-9(3)14-4/h7,9H,5-6H2,1-4H3,(H,11,12).
What are the key properties of 1-ethyl-N-(2-methoxypropyl)-4-methylimidazol-2-amine?
1-ethyl-N-(2-methoxypropyl)-4-methylimidazol-2-amine has a molecular weight of 197.28 g/mol, XLogP of 1.66, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-(2-methoxypropyl)-4-methylimidazol-2-amine is sourced from PubChem (CID 106583458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).