N-[[(1R,2S)-2-cyclohexylcyclopropyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine

C14H25N3 — CID 122096523

IUPACN-[[(1R,2S)-2-cyclohexylcyclopropyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine
SMILESCN1CCN=C1NC[C@@H]1C[C@H]1C1CCCCC1
InChIInChI=1S/C14H25N3/c1-17-8-7-15-14(17)16-10-12-9-13(12)11-5-3-2-4-6-11/h11-13H,2-10H2,1H3,(H,15,16)/t12-,13-/m0/s1
InChIKeyXULADEDYESQWND-STQMWFEESA-N
MW235.37 g/mol
LogP2.09
Rot. Bonds3

About N-[[(1R,2S)-2-cyclohexylcyclopropyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine

N-[[(1R,2S)-2-cyclohexylcyclopropyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine (PubChem CID 122096523) has the molecular formula C14H25N3 and a molecular weight of 235.37 g/mol. Its IUPAC name is N-[[(1R,2S)-2-cyclohexylcyclopropyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine.

Molecular Properties

Compound NameN-[[(1R,2S)-2-cyclohexylcyclopropyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine
PubChem CID122096523
Molecular FormulaC14H25N3
Molecular Weight235.37 g/mol
Exact Mass235.20
IUPAC NameN-[[(1R,2S)-2-cyclohexylcyclopropyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine
SMILESCN1CCN=C1NC[C@@H]1C[C@H]1C1CCCCC1
InChIInChI=1S/C14H25N3/c1-17-8-7-15-14(17)16-10-12-9-13(12)11-5-3-2-4-6-11/h11-13H,2-10H2,1H3,(H,15,16)/t12-,13-/m0/s1
InChIKeyXULADEDYESQWND-STQMWFEESA-N
XLogP2.09
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.37
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[(1R,2S)-2-cyclobutylcyclopropyl]methyl]-1-methyl-5,6-dihydro-4H-pyrimidin-2-amine;hydroiodide
CID 122125696
N-(cyclooctylmethyl)-1-methyl-4,5-dihydroimidazol-2-amine
CID 120970289
1-methyl-N-[(2-propylcyclohexyl)methyl]-4,5-dihydroimidazol-2-amine
CID 122098137
N-(2-cyclohexylcyclopropyl)-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide
CID 120971424
N-[(2-methoxycyclopentyl)methyl]-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide
CID 120971988
N-[2-[[(1-methyl-4,5-dihydroimidazol-2-yl)amino]methyl]cyclohexyl]methanesulfonamide
CID 120973247
1-methyl-N-[(4-methylcyclohexyl)methyl]-4,5-dihydroimidazol-2-amine
CID 120970473
1-methyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]-4,5-dihydroimidazol-2-amine
CID 120972593
N-(2-bicyclo[4.1.0]heptanyl)-1-methyl-4,5-dihydroimidazol-2-amine
CID 164654891
1-methyl-N-(2-piperidin-1-ylethyl)-4,5-dihydroimidazol-2-amine
CID 120969301
N-[(5,5-dimethyloxolan-2-yl)methyl]-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide
CID 120972284
N-[(2,6-dimethyloxan-4-yl)methyl]-1-methyl-5,6-dihydro-4H-pyrimidin-2-amine
CID 122095903

Frequently Asked Questions

What is the IUPAC name of N-[[(1R,2S)-2-cyclohexylcyclopropyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine?
The IUPAC name of N-[[(1R,2S)-2-cyclohexylcyclopropyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine (CID 122096523) is N-[[(1R,2S)-2-cyclohexylcyclopropyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine.
What is the SMILES notation for N-[[(1R,2S)-2-cyclohexylcyclopropyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine?
The canonical SMILES for N-[[(1R,2S)-2-cyclohexylcyclopropyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine is CN1CCN=C1NC[C@@H]1C[C@H]1C1CCCCC1.
What is the InChIKey of N-[[(1R,2S)-2-cyclohexylcyclopropyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine?
The InChIKey is XULADEDYESQWND-STQMWFEESA-N. The full InChI is InChI=1S/C14H25N3/c1-17-8-7-15-14(17)16-10-12-9-13(12)11-5-3-2-4-6-11/h11-13H,2-10H2,1H3,(H,15,16)/t12-,13-/m0/s1.
What are the key properties of N-[[(1R,2S)-2-cyclohexylcyclopropyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine?
N-[[(1R,2S)-2-cyclohexylcyclopropyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine has a molecular weight of 235.37 g/mol, XLogP of 2.09, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(1R,2S)-2-cyclohexylcyclopropyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine is sourced from PubChem (CID 122096523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).