4-methyl-N-(4-methylcyclohexyl)-1-propan-2-ylimidazol-2-amine

C14H25N3 — CID 106560158

IUPAC4-methyl-N-(4-methylcyclohexyl)-1-propan-2-ylimidazol-2-amine
SMILESCc1cn(C(C)C)c(NC2CCC(C)CC2)n1
InChIInChI=1S/C14H25N3/c1-10(2)17-9-12(4)15-14(17)16-13-7-5-11(3)6-8-13/h9-11,13H,5-8H2,1-4H3,(H,15,16)
InChIKeyJZRSNWMKSHCMEO-UHFFFAOYSA-N
MW235.38 g/mol
LogP3.76
Rot. Bonds3

About 4-methyl-N-(4-methylcyclohexyl)-1-propan-2-ylimidazol-2-amine

4-methyl-N-(4-methylcyclohexyl)-1-propan-2-ylimidazol-2-amine (PubChem CID 106560158) has the molecular formula C14H25N3 and a molecular weight of 235.38 g/mol. Its IUPAC name is 4-methyl-N-(4-methylcyclohexyl)-1-propan-2-ylimidazol-2-amine.

Molecular Properties

Compound Name4-methyl-N-(4-methylcyclohexyl)-1-propan-2-ylimidazol-2-amine
PubChem CID106560158
Molecular FormulaC14H25N3
Molecular Weight235.38 g/mol
Exact Mass235.20
IUPAC Name4-methyl-N-(4-methylcyclohexyl)-1-propan-2-ylimidazol-2-amine
SMILESCc1cn(C(C)C)c(NC2CCC(C)CC2)n1
InChIInChI=1S/C14H25N3/c1-10(2)17-9-12(4)15-14(17)16-13-7-5-11(3)6-8-13/h9-11,13H,5-8H2,1-4H3,(H,15,16)
InChIKeyJZRSNWMKSHCMEO-UHFFFAOYSA-N
XLogP3.76
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.38
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(4-methylcyclohexyl)-1-propan-2-ylimidazol-2-amine?
The IUPAC name of 4-methyl-N-(4-methylcyclohexyl)-1-propan-2-ylimidazol-2-amine (CID 106560158) is 4-methyl-N-(4-methylcyclohexyl)-1-propan-2-ylimidazol-2-amine.
What is the SMILES notation for 4-methyl-N-(4-methylcyclohexyl)-1-propan-2-ylimidazol-2-amine?
The canonical SMILES for 4-methyl-N-(4-methylcyclohexyl)-1-propan-2-ylimidazol-2-amine is Cc1cn(C(C)C)c(NC2CCC(C)CC2)n1.
What is the InChIKey of 4-methyl-N-(4-methylcyclohexyl)-1-propan-2-ylimidazol-2-amine?
The InChIKey is JZRSNWMKSHCMEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3/c1-10(2)17-9-12(4)15-14(17)16-13-7-5-11(3)6-8-13/h9-11,13H,5-8H2,1-4H3,(H,15,16).
What are the key properties of 4-methyl-N-(4-methylcyclohexyl)-1-propan-2-ylimidazol-2-amine?
4-methyl-N-(4-methylcyclohexyl)-1-propan-2-ylimidazol-2-amine has a molecular weight of 235.38 g/mol, XLogP of 3.76, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(4-methylcyclohexyl)-1-propan-2-ylimidazol-2-amine is sourced from PubChem (CID 106560158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).