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

C16H29N3O — CID 106564307

IUPACN-(4-ethylcyclohexyl)-1-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine
SMILESCCC1CCC(Nc2nc(C)cn2C(C)COC)CC1
InChIInChI=1S/C16H29N3O/c1-5-14-6-8-15(9-7-14)18-16-17-12(2)10-19(16)13(3)11-20-4/h10,13-15H,5-9,11H2,1-4H3,(H,17,18)
InChIKeyALCWIMCUDJTSCQ-UHFFFAOYSA-N
MW279.43 g/mol
LogP3.78
Rot. Bonds6

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

N-(4-ethylcyclohexyl)-1-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine (PubChem CID 106564307) has the molecular formula C16H29N3O and a molecular weight of 279.43 g/mol. Its IUPAC name is N-(4-ethylcyclohexyl)-1-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine.

Molecular Properties

Compound NameN-(4-ethylcyclohexyl)-1-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine
PubChem CID106564307
Molecular FormulaC16H29N3O
Molecular Weight279.43 g/mol
Exact Mass279.23
IUPAC NameN-(4-ethylcyclohexyl)-1-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine
SMILESCCC1CCC(Nc2nc(C)cn2C(C)COC)CC1
InChIInChI=1S/C16H29N3O/c1-5-14-6-8-15(9-7-14)18-16-17-12(2)10-19(16)13(3)11-20-4/h10,13-15H,5-9,11H2,1-4H3,(H,17,18)
InChIKeyALCWIMCUDJTSCQ-UHFFFAOYSA-N
XLogP3.78
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.43
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3,4-dimethylcyclohexyl)-1-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine
CID 106574577
N-cyclohexyl-1-(1-cyclopropylpropan-2-yl)-4-methylimidazol-2-amine
CID 106572754
N-cyclopropyl-1-(1-cyclopropylbutan-2-yl)-4-methylimidazol-2-amine
CID 106573549
N-(1-cyclohexylpropyl)-1-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine
CID 106571299
N-cyclopropyl-1-(3-ethylpentan-2-yl)-4-methylimidazol-2-amine
CID 106572263
1-(1-methoxypropan-2-yl)-4-methyl-N-propylimidazol-2-amine
CID 106554728
N-cyclopropyl-1-[4-(dimethylamino)butan-2-yl]-4-methylimidazol-2-amine
CID 106567767
N-cyclopentyl-1-hexan-2-yl-4-methylimidazol-2-amine
CID 106569752
1-(1-methoxypropan-2-yl)-4-methyl-N-(3-methylbutan-2-yl)imidazol-2-amine
CID 106554321
4-methyl-N-(4-methylcyclohexyl)-1-propan-2-ylimidazol-2-amine
CID 106560158
N-(2,3-dihydro-1-benzofuran-3-yl)-1-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine
CID 106574403
N-cyclopentyl-4-methyl-1-propan-2-ylimidazol-2-amine
CID 106554830

Frequently Asked Questions

What is the IUPAC name of N-(4-ethylcyclohexyl)-1-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine?
The IUPAC name of N-(4-ethylcyclohexyl)-1-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine (CID 106564307) is N-(4-ethylcyclohexyl)-1-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine.
What is the SMILES notation for N-(4-ethylcyclohexyl)-1-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine?
The canonical SMILES for N-(4-ethylcyclohexyl)-1-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine is CCC1CCC(Nc2nc(C)cn2C(C)COC)CC1.
What is the InChIKey of N-(4-ethylcyclohexyl)-1-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine?
The InChIKey is ALCWIMCUDJTSCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29N3O/c1-5-14-6-8-15(9-7-14)18-16-17-12(2)10-19(16)13(3)11-20-4/h10,13-15H,5-9,11H2,1-4H3,(H,17,18).
What are the key properties of N-(4-ethylcyclohexyl)-1-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine?
N-(4-ethylcyclohexyl)-1-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine has a molecular weight of 279.43 g/mol, XLogP of 3.78, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethylcyclohexyl)-1-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine is sourced from PubChem (CID 106564307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).