1-cyclooctyl-4-methyl-N-(2-methylpropyl)imidazol-2-amine

C16H29N3 — CID 106557175

IUPAC1-cyclooctyl-4-methyl-N-(2-methylpropyl)imidazol-2-amine
SMILESCc1cn(C2CCCCCCC2)c(NCC(C)C)n1
InChIInChI=1S/C16H29N3/c1-13(2)11-17-16-18-14(3)12-19(16)15-9-7-5-4-6-8-10-15/h12-13,15H,4-11H2,1-3H3,(H,17,18)
InChIKeyGMRKUYUOWAYXFN-UHFFFAOYSA-N
MW263.43 g/mol
LogP4.54
Rot. Bonds4

About 1-cyclooctyl-4-methyl-N-(2-methylpropyl)imidazol-2-amine

1-cyclooctyl-4-methyl-N-(2-methylpropyl)imidazol-2-amine (PubChem CID 106557175) has the molecular formula C16H29N3 and a molecular weight of 263.43 g/mol. Its IUPAC name is 1-cyclooctyl-4-methyl-N-(2-methylpropyl)imidazol-2-amine.

Molecular Properties

Compound Name1-cyclooctyl-4-methyl-N-(2-methylpropyl)imidazol-2-amine
PubChem CID106557175
Molecular FormulaC16H29N3
Molecular Weight263.43 g/mol
Exact Mass263.24
IUPAC Name1-cyclooctyl-4-methyl-N-(2-methylpropyl)imidazol-2-amine
SMILESCc1cn(C2CCCCCCC2)c(NCC(C)C)n1
InChIInChI=1S/C16H29N3/c1-13(2)11-17-16-18-14(3)12-19(16)15-9-7-5-4-6-8-10-15/h12-13,15H,4-11H2,1-3H3,(H,17,18)
InChIKeyGMRKUYUOWAYXFN-UHFFFAOYSA-N
XLogP4.54
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.43
LogP ≤ 54.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclohexyl-4-methyl-N-(3-methylbutyl)imidazol-2-amine
CID 106557289
1-cyclopentyl-4-methyl-N-(2-piperidin-1-ylpropyl)imidazol-2-amine
CID 106567951
1-cyclohexyl-N-ethyl-4-methylimidazol-2-amine
CID 106554643
1-(3-ethylcyclohexyl)-4-methyl-N-(2-methylpropyl)imidazol-2-amine
CID 106574917
4-methyl-1-(2-methylcyclohexyl)-N-(2-methylpropyl)imidazol-2-amine
CID 106558973
1-cyclopentyl-4-methyl-N-(2-methylsulfinylpropyl)imidazol-2-amine
CID 106581063
1-cyclopentyl-4-methyl-N-(2-phenylpropyl)imidazol-2-amine
CID 106581012
1-cyclooctyl-4-methyl-N-propylimidazol-2-amine
CID 106557157
1-cyclohexyl-4-methyl-N-[2-(3-methylbutoxy)ethyl]imidazol-2-amine
CID 106568244
1-cyclopropyl-4-methyl-N-(2,3,3-trimethylbutyl)imidazol-2-amine
CID 106579397
1-cyclopentyl-N-(cyclopropylmethyl)-4-methylimidazol-2-amine
CID 106555211
N-(2-cyclohexylethyl)-1-cyclopentyl-4-methylimidazol-2-amine
CID 106563352

Frequently Asked Questions

What is the IUPAC name of 1-cyclooctyl-4-methyl-N-(2-methylpropyl)imidazol-2-amine?
The IUPAC name of 1-cyclooctyl-4-methyl-N-(2-methylpropyl)imidazol-2-amine (CID 106557175) is 1-cyclooctyl-4-methyl-N-(2-methylpropyl)imidazol-2-amine.
What is the SMILES notation for 1-cyclooctyl-4-methyl-N-(2-methylpropyl)imidazol-2-amine?
The canonical SMILES for 1-cyclooctyl-4-methyl-N-(2-methylpropyl)imidazol-2-amine is Cc1cn(C2CCCCCCC2)c(NCC(C)C)n1.
What is the InChIKey of 1-cyclooctyl-4-methyl-N-(2-methylpropyl)imidazol-2-amine?
The InChIKey is GMRKUYUOWAYXFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29N3/c1-13(2)11-17-16-18-14(3)12-19(16)15-9-7-5-4-6-8-10-15/h12-13,15H,4-11H2,1-3H3,(H,17,18).
What are the key properties of 1-cyclooctyl-4-methyl-N-(2-methylpropyl)imidazol-2-amine?
1-cyclooctyl-4-methyl-N-(2-methylpropyl)imidazol-2-amine has a molecular weight of 263.43 g/mol, XLogP of 4.54, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclooctyl-4-methyl-N-(2-methylpropyl)imidazol-2-amine is sourced from PubChem (CID 106557175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).