N-cyclooctyl-4-methyl-1-propylimidazol-2-amine

C15H27N3 — CID 106557173

IUPACN-cyclooctyl-4-methyl-1-propylimidazol-2-amine
SMILESCCCn1cc(C)nc1NC1CCCCCCC1
InChIInChI=1S/C15H27N3/c1-3-11-18-12-13(2)16-15(18)17-14-9-7-5-4-6-8-10-14/h12,14H,3-11H2,1-2H3,(H,16,17)
InChIKeySADNCDRFQJYADI-UHFFFAOYSA-N
MW249.40 g/mol
LogP4.13
Rot. Bonds4

About N-cyclooctyl-4-methyl-1-propylimidazol-2-amine

N-cyclooctyl-4-methyl-1-propylimidazol-2-amine (PubChem CID 106557173) has the molecular formula C15H27N3 and a molecular weight of 249.40 g/mol. Its IUPAC name is N-cyclooctyl-4-methyl-1-propylimidazol-2-amine.

Molecular Properties

Compound NameN-cyclooctyl-4-methyl-1-propylimidazol-2-amine
PubChem CID106557173
Molecular FormulaC15H27N3
Molecular Weight249.40 g/mol
Exact Mass249.22
IUPAC NameN-cyclooctyl-4-methyl-1-propylimidazol-2-amine
SMILESCCCn1cc(C)nc1NC1CCCCCCC1
InChIInChI=1S/C15H27N3/c1-3-11-18-12-13(2)16-15(18)17-14-9-7-5-4-6-8-10-14/h12,14H,3-11H2,1-2H3,(H,16,17)
InChIKeySADNCDRFQJYADI-UHFFFAOYSA-N
XLogP4.13
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.40
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-methyl-1-propyl-N-(thian-4-yl)imidazol-2-amine
CID 106582146
N-cyclopentyl-1-(2-methoxyethyl)-4-methylimidazol-2-amine
CID 106554862
4-methyl-N-(3-methylcyclopentyl)-1-propylimidazol-2-amine
CID 106581853
N-cyclopentyl-4-methyl-1-(2-pyrazol-1-ylethyl)imidazol-2-amine
CID 106568575
N-cyclohexyl-4-methyl-1-(3-pyrrolidin-1-ylpropyl)imidazol-2-amine
CID 106572074
N-cyclohexyl-4-methyl-1-(5-methylhexyl)imidazol-2-amine
CID 106578468
N-cyclohexyl-4-methyl-1-[(4-methylcyclohexyl)methyl]imidazol-2-amine
CID 106571766
N-(3,4-dimethylcyclohexyl)-4-methyl-1-propylimidazol-2-amine
CID 106574600
N-cyclohexyl-4-methyl-1-[2-[methyl(propan-2-yl)amino]ethyl]imidazol-2-amine
CID 106570476
N-cyclopentyl-1-[4-(dimethylamino)butyl]-4-methylimidazol-2-amine
CID 106565566
N-cyclopentyl-4-methyl-1-(4,4,4-trifluorobutyl)imidazol-2-amine
CID 106579134
N-cyclopentyl-4-methyl-1-(3-pyrazol-1-ylpropyl)imidazol-2-amine
CID 106579652

Frequently Asked Questions

What is the IUPAC name of N-cyclooctyl-4-methyl-1-propylimidazol-2-amine?
The IUPAC name of N-cyclooctyl-4-methyl-1-propylimidazol-2-amine (CID 106557173) is N-cyclooctyl-4-methyl-1-propylimidazol-2-amine.
What is the SMILES notation for N-cyclooctyl-4-methyl-1-propylimidazol-2-amine?
The canonical SMILES for N-cyclooctyl-4-methyl-1-propylimidazol-2-amine is CCCn1cc(C)nc1NC1CCCCCCC1.
What is the InChIKey of N-cyclooctyl-4-methyl-1-propylimidazol-2-amine?
The InChIKey is SADNCDRFQJYADI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3/c1-3-11-18-12-13(2)16-15(18)17-14-9-7-5-4-6-8-10-14/h12,14H,3-11H2,1-2H3,(H,16,17).
What are the key properties of N-cyclooctyl-4-methyl-1-propylimidazol-2-amine?
N-cyclooctyl-4-methyl-1-propylimidazol-2-amine has a molecular weight of 249.40 g/mol, XLogP of 4.13, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclooctyl-4-methyl-1-propylimidazol-2-amine is sourced from PubChem (CID 106557173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).