1-hexan-2-yl-N-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine

C14H27N3O — CID 106569750

IUPAC1-hexan-2-yl-N-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine
SMILESCCCCC(C)n1cc(C)nc1NC(C)COC
InChIInChI=1S/C14H27N3O/c1-6-7-8-13(4)17-9-11(2)15-14(17)16-12(3)10-18-5/h9,12-13H,6-8,10H2,1-5H3,(H,15,16)
InChIKeySIDBNSHUNCJDOX-UHFFFAOYSA-N
MW253.39 g/mol
LogP3.39
Rot. Bonds8

About 1-hexan-2-yl-N-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine

1-hexan-2-yl-N-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine (PubChem CID 106569750) has the molecular formula C14H27N3O and a molecular weight of 253.39 g/mol. Its IUPAC name is 1-hexan-2-yl-N-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine.

Molecular Properties

Compound Name1-hexan-2-yl-N-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine
PubChem CID106569750
Molecular FormulaC14H27N3O
Molecular Weight253.39 g/mol
Exact Mass253.22
IUPAC Name1-hexan-2-yl-N-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine
SMILESCCCCC(C)n1cc(C)nc1NC(C)COC
InChIInChI=1S/C14H27N3O/c1-6-7-8-13(4)17-9-11(2)15-14(17)16-12(3)10-18-5/h9,12-13H,6-8,10H2,1-5H3,(H,15,16)
InChIKeySIDBNSHUNCJDOX-UHFFFAOYSA-N
XLogP3.39
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-heptan-2-yl-N-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine
CID 106568882
N-(1-methoxypropan-2-yl)-4-methyl-1-propan-2-ylimidazol-2-amine
CID 106554828
1-hexan-2-yl-N-(2-methoxyethyl)-4-methylimidazol-2-amine
CID 106569745
1-[1-(dimethylamino)propan-2-yl]-N-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine
CID 106578638
1-(1-methoxypropan-2-yl)-4-methyl-N-(4-methylpentan-2-yl)imidazol-2-amine
CID 106561678
1-(1-methoxypropan-2-yl)-4-methyl-N-(3-methylbutan-2-yl)imidazol-2-amine
CID 106554321
1-(1-methoxypropan-2-yl)-4-methyl-N-propylimidazol-2-amine
CID 106554728
N-(1-methoxy-3-methylbutan-2-yl)-1-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine
CID 106575059
N-cyclopentyl-1-hexan-2-yl-4-methylimidazol-2-amine
CID 106569752
N-(1-methoxypropan-2-yl)-4-methyl-1-(1-thiophen-3-ylethyl)imidazol-2-amine
CID 106570907
1-(1-methoxypropan-2-yl)-4-methyl-N-(1-morpholin-4-ylpropan-2-yl)imidazol-2-amine
CID 106568507
1-(2,2-dimethylbutyl)-N-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine
CID 106583486

Frequently Asked Questions

What is the IUPAC name of 1-hexan-2-yl-N-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine?
The IUPAC name of 1-hexan-2-yl-N-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine (CID 106569750) is 1-hexan-2-yl-N-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine.
What is the SMILES notation for 1-hexan-2-yl-N-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine?
The canonical SMILES for 1-hexan-2-yl-N-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine is CCCCC(C)n1cc(C)nc1NC(C)COC.
What is the InChIKey of 1-hexan-2-yl-N-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine?
The InChIKey is SIDBNSHUNCJDOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O/c1-6-7-8-13(4)17-9-11(2)15-14(17)16-12(3)10-18-5/h9,12-13H,6-8,10H2,1-5H3,(H,15,16).
What are the key properties of 1-hexan-2-yl-N-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine?
1-hexan-2-yl-N-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine has a molecular weight of 253.39 g/mol, XLogP of 3.39, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hexan-2-yl-N-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine is sourced from PubChem (CID 106569750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).