4-N-(4,5-dihydro-1H-imidazol-2-yl)-1-N,4-N-dimethylcyclohexane-1,4-diamine

C11H22N4 — CID 114400584

IUPAC4-N-(4,5-dihydro-1H-imidazol-2-yl)-1-N,4-N-dimethylcyclohexane-1,4-diamine
SMILESCNC1CCC(N(C)C2=NCCN2)CC1
InChIInChI=1S/C11H22N4/c1-12-9-3-5-10(6-4-9)15(2)11-13-7-8-14-11/h9-10,12H,3-8H2,1-2H3,(H,13,14)
InChIKeyNNGRPJNAGNTCSX-UHFFFAOYSA-N
MW210.32 g/mol
LogP0.41
Rot. Bonds2

About 4-N-(4,5-dihydro-1H-imidazol-2-yl)-1-N,4-N-dimethylcyclohexane-1,4-diamine

4-N-(4,5-dihydro-1H-imidazol-2-yl)-1-N,4-N-dimethylcyclohexane-1,4-diamine (PubChem CID 114400584) has the molecular formula C11H22N4 and a molecular weight of 210.32 g/mol. Its IUPAC name is 4-N-(4,5-dihydro-1H-imidazol-2-yl)-1-N,4-N-dimethylcyclohexane-1,4-diamine.

Molecular Properties

Compound Name4-N-(4,5-dihydro-1H-imidazol-2-yl)-1-N,4-N-dimethylcyclohexane-1,4-diamine
PubChem CID114400584
Molecular FormulaC11H22N4
Molecular Weight210.32 g/mol
Exact Mass210.18
IUPAC Name4-N-(4,5-dihydro-1H-imidazol-2-yl)-1-N,4-N-dimethylcyclohexane-1,4-diamine
SMILESCNC1CCC(N(C)C2=NCCN2)CC1
InChIInChI=1S/C11H22N4/c1-12-9-3-5-10(6-4-9)15(2)11-13-7-8-14-11/h9-10,12H,3-8H2,1-2H3,(H,13,14)
InChIKeyNNGRPJNAGNTCSX-UHFFFAOYSA-N
XLogP0.41
TPSA39.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 50.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-N-(4,5-dihydro-1H-imidazol-2-yl)-1-N,4-N-dimethylcyclohexane-1,4-diamine with MolForge

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Related Compounds

4-[methyl-[4-(methylamino)cyclohexyl]amino]benzonitrile
CID 79111258
4-N-(3-bromo-2-pyridinyl)-1-N,4-N-dimethylcyclohexane-1,4-diamine
CID 79110265
1-N,4-N-dimethyl-4-N-(3-methyl-1,2,4-thiadiazol-5-yl)cyclohexane-1,4-diamine
CID 79111027
1-N,4-N-dimethyl-4-N-(5-methyl-2-pyridinyl)cyclohexane-1,4-diamine
CID 79123141
1-N,4-N-dimethyl-4-N-(6-methyl-2-pyridinyl)cyclohexane-1,4-diamine
CID 79122150
4-N-(6-chloropyridazin-3-yl)-1-N,4-N-dimethylcyclohexane-1,4-diamine
CID 79110952
N-cyclopropyl-N-(piperidin-4-ylmethyl)-4,5-dihydro-1H-imidazol-2-amine
CID 114400593
4-N-(3-ethyl-1,2,4-thiadiazol-5-yl)-1-N,4-N-dimethylcyclohexane-1,4-diamine
CID 79110800
1-N,4-N-dimethyl-4-N-(3-methylquinoxalin-2-yl)cyclohexane-1,4-diamine
CID 79117532
4-N-tert-butyl-1-N,4-N-dimethylcyclohexane-1,4-diamine
CID 117029205
methane;2-methylpropane;2-propan-2-yl-4,5-dihydro-1H-imidazole
CID 159534289
4-N-cyclooctyl-1-N,4-N-dimethylcyclohexane-1,4-diamine
CID 79122769

Frequently Asked Questions

What is the IUPAC name of 4-N-(4,5-dihydro-1H-imidazol-2-yl)-1-N,4-N-dimethylcyclohexane-1,4-diamine?
The IUPAC name of 4-N-(4,5-dihydro-1H-imidazol-2-yl)-1-N,4-N-dimethylcyclohexane-1,4-diamine (CID 114400584) is 4-N-(4,5-dihydro-1H-imidazol-2-yl)-1-N,4-N-dimethylcyclohexane-1,4-diamine.
What is the SMILES notation for 4-N-(4,5-dihydro-1H-imidazol-2-yl)-1-N,4-N-dimethylcyclohexane-1,4-diamine?
The canonical SMILES for 4-N-(4,5-dihydro-1H-imidazol-2-yl)-1-N,4-N-dimethylcyclohexane-1,4-diamine is CNC1CCC(N(C)C2=NCCN2)CC1.
What is the InChIKey of 4-N-(4,5-dihydro-1H-imidazol-2-yl)-1-N,4-N-dimethylcyclohexane-1,4-diamine?
The InChIKey is NNGRPJNAGNTCSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N4/c1-12-9-3-5-10(6-4-9)15(2)11-13-7-8-14-11/h9-10,12H,3-8H2,1-2H3,(H,13,14).
What are the key properties of 4-N-(4,5-dihydro-1H-imidazol-2-yl)-1-N,4-N-dimethylcyclohexane-1,4-diamine?
4-N-(4,5-dihydro-1H-imidazol-2-yl)-1-N,4-N-dimethylcyclohexane-1,4-diamine has a molecular weight of 210.32 g/mol, XLogP of 0.41, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(4,5-dihydro-1H-imidazol-2-yl)-1-N,4-N-dimethylcyclohexane-1,4-diamine is sourced from PubChem (CID 114400584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).