1-cyclohexyl-N-(1-methoxypropan-2-yl)imidazol-2-amine

C13H23N3O — CID 106554635

IUPAC1-cyclohexyl-N-(1-methoxypropan-2-yl)imidazol-2-amine
SMILESCOCC(C)Nc1nccn1C1CCCCC1
InChIInChI=1S/C13H23N3O/c1-11(10-17-2)15-13-14-8-9-16(13)12-6-4-3-5-7-12/h8-9,11-12H,3-7,10H2,1-2H3,(H,14,15)
InChIKeyFKMKAKLDGFIOIR-UHFFFAOYSA-N
MW237.35 g/mol
LogP2.84
Rot. Bonds5

About 1-cyclohexyl-N-(1-methoxypropan-2-yl)imidazol-2-amine

1-cyclohexyl-N-(1-methoxypropan-2-yl)imidazol-2-amine (PubChem CID 106554635) has the molecular formula C13H23N3O and a molecular weight of 237.35 g/mol. Its IUPAC name is 1-cyclohexyl-N-(1-methoxypropan-2-yl)imidazol-2-amine.

Molecular Properties

Compound Name1-cyclohexyl-N-(1-methoxypropan-2-yl)imidazol-2-amine
PubChem CID106554635
Molecular FormulaC13H23N3O
Molecular Weight237.35 g/mol
Exact Mass237.18
IUPAC Name1-cyclohexyl-N-(1-methoxypropan-2-yl)imidazol-2-amine
SMILESCOCC(C)Nc1nccn1C1CCCCC1
InChIInChI=1S/C13H23N3O/c1-11(10-17-2)15-13-14-8-9-16(13)12-6-4-3-5-7-12/h8-9,11-12H,3-7,10H2,1-2H3,(H,14,15)
InChIKeyFKMKAKLDGFIOIR-UHFFFAOYSA-N
XLogP2.84
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.35
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-methoxypropan-2-yl)-1-(1-oxothian-4-yl)imidazol-2-amine
CID 106580407
1-cyclohexyl-N-(4-methylpentan-2-yl)imidazol-2-amine
CID 106561711
N-(1-methoxypropan-2-yl)-1-(thiolan-3-yl)imidazol-2-amine
CID 106583133
1-cyclopentyl-N-(1-methoxypentan-2-yl)imidazol-2-amine
CID 106574824
1-cyclohexyl-N-(3-methylbutan-2-yl)imidazol-2-amine
CID 106554339
N-(1-methoxypropan-2-yl)-1-(thian-2-ylmethyl)imidazol-2-amine
CID 106577112
N-(1-methoxypropan-2-yl)-1-(oxolan-2-ylmethyl)imidazol-2-amine
CID 106560082
N-(1-methoxypropan-2-yl)-1-[2-(3-methylcyclohexyl)ethyl]imidazol-2-amine
CID 106574347
N,1-bis(1-methoxypropan-2-yl)imidazol-2-amine
CID 106556138
1-cyclopentyl-N-(2,3-dimethylbutyl)imidazol-2-amine
CID 106575250
N-(1-methoxypropan-2-yl)-1-(3-methylbutyl)imidazol-2-amine
CID 106557283
1-(2,3-dihydro-1-benzofuran-3-yl)-N-(1-methoxypropan-2-yl)imidazol-2-amine
CID 106574399

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-N-(1-methoxypropan-2-yl)imidazol-2-amine?
The IUPAC name of 1-cyclohexyl-N-(1-methoxypropan-2-yl)imidazol-2-amine (CID 106554635) is 1-cyclohexyl-N-(1-methoxypropan-2-yl)imidazol-2-amine.
What is the SMILES notation for 1-cyclohexyl-N-(1-methoxypropan-2-yl)imidazol-2-amine?
The canonical SMILES for 1-cyclohexyl-N-(1-methoxypropan-2-yl)imidazol-2-amine is COCC(C)Nc1nccn1C1CCCCC1.
What is the InChIKey of 1-cyclohexyl-N-(1-methoxypropan-2-yl)imidazol-2-amine?
The InChIKey is FKMKAKLDGFIOIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O/c1-11(10-17-2)15-13-14-8-9-16(13)12-6-4-3-5-7-12/h8-9,11-12H,3-7,10H2,1-2H3,(H,14,15).
What are the key properties of 1-cyclohexyl-N-(1-methoxypropan-2-yl)imidazol-2-amine?
1-cyclohexyl-N-(1-methoxypropan-2-yl)imidazol-2-amine has a molecular weight of 237.35 g/mol, XLogP of 2.84, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-N-(1-methoxypropan-2-yl)imidazol-2-amine is sourced from PubChem (CID 106554635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).