2-cyclohexyl-5-(2,2-dimethylpropyl)-3-ethylimidazol-4-amine

C16H29N3 — CID 62966189

IUPAC2-cyclohexyl-5-(2,2-dimethylpropyl)-3-ethylimidazol-4-amine
SMILESCCn1c(C2CCCCC2)nc(CC(C)(C)C)c1N
InChIInChI=1S/C16H29N3/c1-5-19-14(17)13(11-16(2,3)4)18-15(19)12-9-7-6-8-10-12/h12H,5-11,17H2,1-4H3
InChIKeyQJZGGUJYPSHWOR-UHFFFAOYSA-N
MW263.43 g/mol
LogP4.12
Rot. Bonds3

About 2-cyclohexyl-5-(2,2-dimethylpropyl)-3-ethylimidazol-4-amine

2-cyclohexyl-5-(2,2-dimethylpropyl)-3-ethylimidazol-4-amine (PubChem CID 62966189) has the molecular formula C16H29N3 and a molecular weight of 263.43 g/mol. Its IUPAC name is 2-cyclohexyl-5-(2,2-dimethylpropyl)-3-ethylimidazol-4-amine.

Molecular Properties

Compound Name2-cyclohexyl-5-(2,2-dimethylpropyl)-3-ethylimidazol-4-amine
PubChem CID62966189
Molecular FormulaC16H29N3
Molecular Weight263.43 g/mol
Exact Mass263.24
IUPAC Name2-cyclohexyl-5-(2,2-dimethylpropyl)-3-ethylimidazol-4-amine
SMILESCCn1c(C2CCCCC2)nc(CC(C)(C)C)c1N
InChIInChI=1S/C16H29N3/c1-5-19-14(17)13(11-16(2,3)4)18-15(19)12-9-7-6-8-10-12/h12H,5-11,17H2,1-4H3
InChIKeyQJZGGUJYPSHWOR-UHFFFAOYSA-N
XLogP4.12
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.43
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-5-(2,2-dimethylpropyl)-3-ethylimidazol-4-amine?
The IUPAC name of 2-cyclohexyl-5-(2,2-dimethylpropyl)-3-ethylimidazol-4-amine (CID 62966189) is 2-cyclohexyl-5-(2,2-dimethylpropyl)-3-ethylimidazol-4-amine.
What is the SMILES notation for 2-cyclohexyl-5-(2,2-dimethylpropyl)-3-ethylimidazol-4-amine?
The canonical SMILES for 2-cyclohexyl-5-(2,2-dimethylpropyl)-3-ethylimidazol-4-amine is CCn1c(C2CCCCC2)nc(CC(C)(C)C)c1N.
What is the InChIKey of 2-cyclohexyl-5-(2,2-dimethylpropyl)-3-ethylimidazol-4-amine?
The InChIKey is QJZGGUJYPSHWOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29N3/c1-5-19-14(17)13(11-16(2,3)4)18-15(19)12-9-7-6-8-10-12/h12H,5-11,17H2,1-4H3.
What are the key properties of 2-cyclohexyl-5-(2,2-dimethylpropyl)-3-ethylimidazol-4-amine?
2-cyclohexyl-5-(2,2-dimethylpropyl)-3-ethylimidazol-4-amine has a molecular weight of 263.43 g/mol, XLogP of 4.12, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-5-(2,2-dimethylpropyl)-3-ethylimidazol-4-amine is sourced from PubChem (CID 62966189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).