N'-(1-cyclopentyl-4-methylimidazol-2-yl)-N',2,2-trimethylpropane-1,3-diamine

C15H28N4 — CID 106553146

IUPACN'-(1-cyclopentyl-4-methylimidazol-2-yl)-N',2,2-trimethylpropane-1,3-diamine
SMILESCc1cn(C2CCCC2)c(N(C)CC(C)(C)CN)n1
InChIInChI=1S/C15H28N4/c1-12-9-19(13-7-5-6-8-13)14(17-12)18(4)11-15(2,3)10-16/h9,13H,5-8,10-11,16H2,1-4H3
InChIKeyJDSQAUWDHJLFSO-UHFFFAOYSA-N
MW264.42 g/mol
LogP2.73
Rot. Bonds5

About N'-(1-cyclopentyl-4-methylimidazol-2-yl)-N',2,2-trimethylpropane-1,3-diamine

N'-(1-cyclopentyl-4-methylimidazol-2-yl)-N',2,2-trimethylpropane-1,3-diamine (PubChem CID 106553146) has the molecular formula C15H28N4 and a molecular weight of 264.42 g/mol. Its IUPAC name is N'-(1-cyclopentyl-4-methylimidazol-2-yl)-N',2,2-trimethylpropane-1,3-diamine.

Molecular Properties

Compound NameN'-(1-cyclopentyl-4-methylimidazol-2-yl)-N',2,2-trimethylpropane-1,3-diamine
PubChem CID106553146
Molecular FormulaC15H28N4
Molecular Weight264.42 g/mol
Exact Mass264.23
IUPAC NameN'-(1-cyclopentyl-4-methylimidazol-2-yl)-N',2,2-trimethylpropane-1,3-diamine
SMILESCc1cn(C2CCCC2)c(N(C)CC(C)(C)CN)n1
InChIInChI=1S/C15H28N4/c1-12-9-19(13-7-5-6-8-13)14(17-12)18(4)11-15(2,3)10-16/h9,13H,5-8,10-11,16H2,1-4H3
InChIKeyJDSQAUWDHJLFSO-UHFFFAOYSA-N
XLogP2.73
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.42
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-cyclopropyl-N,4-dimethyl-N-(piperidin-4-ylmethyl)imidazol-2-amine
CID 106553042
N-(1-cyclohexyl-4-methylimidazol-2-yl)-N-ethylpiperidin-3-amine
CID 106551771
N'-(1-cyclohexyl-4-ethylimidazol-2-yl)-N'-methylpropane-1,3-diamine
CID 106553612
N-(1-cyclohexyl-4-methylimidazol-2-yl)-N-methylpiperidin-3-amine
CID 106551809
1-cyclohexyl-N-(3-ethylpentan-3-yl)-4-methylimidazol-2-amine
CID 106574939
1-cyclobutyl-4-methylimidazol-2-amine
CID 103840674
1-cyclohexyl-N-ethyl-4-methylimidazol-2-amine
CID 106554643
1-cyclooctyl-4-methyl-N-(2-methylpropyl)imidazol-2-amine
CID 106557175
N-(2-cyclohexylethyl)-1-cyclopentyl-4-methylimidazol-2-amine
CID 106563352
1-cyclopentyl-4-methyl-N-(2-piperidin-1-ylpropyl)imidazol-2-amine
CID 106567951
1-cyclooctyl-4-methyl-N-propylimidazol-2-amine
CID 106557157
[1-(1-cyclohexyl-4-methylimidazol-2-yl)-6-methylpiperidin-3-yl]methanamine
CID 106552867

Frequently Asked Questions

What is the IUPAC name of N'-(1-cyclopentyl-4-methylimidazol-2-yl)-N',2,2-trimethylpropane-1,3-diamine?
The IUPAC name of N'-(1-cyclopentyl-4-methylimidazol-2-yl)-N',2,2-trimethylpropane-1,3-diamine (CID 106553146) is N'-(1-cyclopentyl-4-methylimidazol-2-yl)-N',2,2-trimethylpropane-1,3-diamine.
What is the SMILES notation for N'-(1-cyclopentyl-4-methylimidazol-2-yl)-N',2,2-trimethylpropane-1,3-diamine?
The canonical SMILES for N'-(1-cyclopentyl-4-methylimidazol-2-yl)-N',2,2-trimethylpropane-1,3-diamine is Cc1cn(C2CCCC2)c(N(C)CC(C)(C)CN)n1.
What is the InChIKey of N'-(1-cyclopentyl-4-methylimidazol-2-yl)-N',2,2-trimethylpropane-1,3-diamine?
The InChIKey is JDSQAUWDHJLFSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4/c1-12-9-19(13-7-5-6-8-13)14(17-12)18(4)11-15(2,3)10-16/h9,13H,5-8,10-11,16H2,1-4H3.
What are the key properties of N'-(1-cyclopentyl-4-methylimidazol-2-yl)-N',2,2-trimethylpropane-1,3-diamine?
N'-(1-cyclopentyl-4-methylimidazol-2-yl)-N',2,2-trimethylpropane-1,3-diamine has a molecular weight of 264.42 g/mol, XLogP of 2.73, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(1-cyclopentyl-4-methylimidazol-2-yl)-N',2,2-trimethylpropane-1,3-diamine is sourced from PubChem (CID 106553146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).