N-cyclohexyl-1-(4,4-dimethylcyclohexyl)imidazol-2-amine

C17H29N3 — CID 106574656

IUPACN-cyclohexyl-1-(4,4-dimethylcyclohexyl)imidazol-2-amine
SMILESCC1(C)CCC(n2ccnc2NC2CCCCC2)CC1
InChIInChI=1S/C17H29N3/c1-17(2)10-8-15(9-11-17)20-13-12-18-16(20)19-14-6-4-3-5-7-14/h12-15H,3-11H2,1-2H3,(H,18,19)
InChIKeyNGUCIMCVHQZING-UHFFFAOYSA-N
MW275.44 g/mol
LogP4.77
Rot. Bonds3

About N-cyclohexyl-1-(4,4-dimethylcyclohexyl)imidazol-2-amine

N-cyclohexyl-1-(4,4-dimethylcyclohexyl)imidazol-2-amine (PubChem CID 106574656) has the molecular formula C17H29N3 and a molecular weight of 275.44 g/mol. Its IUPAC name is N-cyclohexyl-1-(4,4-dimethylcyclohexyl)imidazol-2-amine.

Molecular Properties

Compound NameN-cyclohexyl-1-(4,4-dimethylcyclohexyl)imidazol-2-amine
PubChem CID106574656
Molecular FormulaC17H29N3
Molecular Weight275.44 g/mol
Exact Mass275.24
IUPAC NameN-cyclohexyl-1-(4,4-dimethylcyclohexyl)imidazol-2-amine
SMILESCC1(C)CCC(n2ccnc2NC2CCCCC2)CC1
InChIInChI=1S/C17H29N3/c1-17(2)10-8-15(9-11-17)20-13-12-18-16(20)19-14-6-4-3-5-7-14/h12-15H,3-11H2,1-2H3,(H,18,19)
InChIKeyNGUCIMCVHQZING-UHFFFAOYSA-N
XLogP4.77
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.44
LogP ≤ 54.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-1-(4,4-dimethylcyclohexyl)imidazol-2-amine?
The IUPAC name of N-cyclohexyl-1-(4,4-dimethylcyclohexyl)imidazol-2-amine (CID 106574656) is N-cyclohexyl-1-(4,4-dimethylcyclohexyl)imidazol-2-amine.
What is the SMILES notation for N-cyclohexyl-1-(4,4-dimethylcyclohexyl)imidazol-2-amine?
The canonical SMILES for N-cyclohexyl-1-(4,4-dimethylcyclohexyl)imidazol-2-amine is CC1(C)CCC(n2ccnc2NC2CCCCC2)CC1.
What is the InChIKey of N-cyclohexyl-1-(4,4-dimethylcyclohexyl)imidazol-2-amine?
The InChIKey is NGUCIMCVHQZING-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29N3/c1-17(2)10-8-15(9-11-17)20-13-12-18-16(20)19-14-6-4-3-5-7-14/h12-15H,3-11H2,1-2H3,(H,18,19).
What are the key properties of N-cyclohexyl-1-(4,4-dimethylcyclohexyl)imidazol-2-amine?
N-cyclohexyl-1-(4,4-dimethylcyclohexyl)imidazol-2-amine has a molecular weight of 275.44 g/mol, XLogP of 4.77, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-1-(4,4-dimethylcyclohexyl)imidazol-2-amine is sourced from PubChem (CID 106574656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).