4-[4-(methoxymethyl)-5-methyl-1H-imidazol-2-yl]cyclohexan-1-amine

C12H21N3O — CID 82237217

IUPAC4-[4-(methoxymethyl)-5-methyl-1H-imidazol-2-yl]cyclohexan-1-amine
SMILESCOCc1nc(C2CCC(N)CC2)[nH]c1C
InChIInChI=1S/C12H21N3O/c1-8-11(7-16-2)15-12(14-8)9-3-5-10(13)6-4-9/h9-10H,3-7,13H2,1-2H3,(H,14,15)
InChIKeyLOHBXUQKAUTCGT-UHFFFAOYSA-N
MW223.32 g/mol
LogP1.85
Rot. Bonds3

About 4-[4-(methoxymethyl)-5-methyl-1H-imidazol-2-yl]cyclohexan-1-amine

4-[4-(methoxymethyl)-5-methyl-1H-imidazol-2-yl]cyclohexan-1-amine (PubChem CID 82237217) has the molecular formula C12H21N3O and a molecular weight of 223.32 g/mol. Its IUPAC name is 4-[4-(methoxymethyl)-5-methyl-1H-imidazol-2-yl]cyclohexan-1-amine.

Molecular Properties

Compound Name4-[4-(methoxymethyl)-5-methyl-1H-imidazol-2-yl]cyclohexan-1-amine
PubChem CID82237217
Molecular FormulaC12H21N3O
Molecular Weight223.32 g/mol
Exact Mass223.17
IUPAC Name4-[4-(methoxymethyl)-5-methyl-1H-imidazol-2-yl]cyclohexan-1-amine
SMILESCOCc1nc(C2CCC(N)CC2)[nH]c1C
InChIInChI=1S/C12H21N3O/c1-8-11(7-16-2)15-12(14-8)9-3-5-10(13)6-4-9/h9-10H,3-7,13H2,1-2H3,(H,14,15)
InChIKeyLOHBXUQKAUTCGT-UHFFFAOYSA-N
XLogP1.85
TPSA63.93 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 51.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[4-(methoxymethyl)-5-methyl-1H-imidazol-2-yl]cyclohexan-1-amine
CID 82237881
2-cyclopropyl-4-ethyl-5-methyl-1H-imidazole
CID 123293833
[2-cyclopropyl-5-(methoxymethyl)-1H-imidazol-4-yl]methanamine
CID 96589936
4-(methoxymethyl)-2-(4-methoxypyrrolidin-2-yl)-5-methyl-1H-imidazole
CID 114999046
[5-methyl-2-(oxolan-3-yl)-1H-imidazol-4-yl]methanamine
CID 115015957
[2-(1,1-dioxothiolan-3-yl)-5-methyl-1H-imidazol-4-yl]methanamine
CID 115037326
5-[4-(methoxymethyl)-5-methyl-1H-imidazol-2-yl]pentan-1-amine
CID 114999252
5,6-dimethyl-2-(4-propylcyclohexyl)-1H-pyrimidine-4-thione
CID 106476764
2-cyclopentyl-6-(methoxymethyl)-1H-pyrimidine-4-thione
CID 106477585
4-(azetidin-3-yl)-2-cyclobutyl-5-methyl-1H-imidazole
CID 105445538
3-[2-(1,1-dioxothiolan-3-yl)-5-methyl-1H-imidazol-4-yl]propan-1-amine
CID 115048088
2-cyclopropyl-4-[[2-(methoxymethyl)phenyl]methylamino]-1H-pyrimidin-6-one
CID 136974262

Frequently Asked Questions

What is the IUPAC name of 4-[4-(methoxymethyl)-5-methyl-1H-imidazol-2-yl]cyclohexan-1-amine?
The IUPAC name of 4-[4-(methoxymethyl)-5-methyl-1H-imidazol-2-yl]cyclohexan-1-amine (CID 82237217) is 4-[4-(methoxymethyl)-5-methyl-1H-imidazol-2-yl]cyclohexan-1-amine.
What is the SMILES notation for 4-[4-(methoxymethyl)-5-methyl-1H-imidazol-2-yl]cyclohexan-1-amine?
The canonical SMILES for 4-[4-(methoxymethyl)-5-methyl-1H-imidazol-2-yl]cyclohexan-1-amine is COCc1nc(C2CCC(N)CC2)[nH]c1C.
What is the InChIKey of 4-[4-(methoxymethyl)-5-methyl-1H-imidazol-2-yl]cyclohexan-1-amine?
The InChIKey is LOHBXUQKAUTCGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O/c1-8-11(7-16-2)15-12(14-8)9-3-5-10(13)6-4-9/h9-10H,3-7,13H2,1-2H3,(H,14,15).
What are the key properties of 4-[4-(methoxymethyl)-5-methyl-1H-imidazol-2-yl]cyclohexan-1-amine?
4-[4-(methoxymethyl)-5-methyl-1H-imidazol-2-yl]cyclohexan-1-amine has a molecular weight of 223.32 g/mol, XLogP of 1.85, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(methoxymethyl)-5-methyl-1H-imidazol-2-yl]cyclohexan-1-amine is sourced from PubChem (CID 82237217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).