N-(2,2,3,3-tetramethylbutyl)-4,5-dihydro-1H-imidazol-2-amine

C11H23N3 — CID 127013356

IUPACN-(2,2,3,3-tetramethylbutyl)-4,5-dihydro-1H-imidazol-2-amine
SMILESCC(C)(C)C(C)(C)CNC1=NCCN1
InChIInChI=1S/C11H23N3/c1-10(2,3)11(4,5)8-14-9-12-6-7-13-9/h6-8H2,1-5H3,(H2,12,13,14)
InChIKeyCPSITOZRXZSGGI-UHFFFAOYSA-N
MW197.33 g/mol
LogP1.61
Rot. Bonds2

About N-(2,2,3,3-tetramethylbutyl)-4,5-dihydro-1H-imidazol-2-amine

N-(2,2,3,3-tetramethylbutyl)-4,5-dihydro-1H-imidazol-2-amine (PubChem CID 127013356) has the molecular formula C11H23N3 and a molecular weight of 197.33 g/mol. Its IUPAC name is N-(2,2,3,3-tetramethylbutyl)-4,5-dihydro-1H-imidazol-2-amine.

Molecular Properties

Compound NameN-(2,2,3,3-tetramethylbutyl)-4,5-dihydro-1H-imidazol-2-amine
PubChem CID127013356
Molecular FormulaC11H23N3
Molecular Weight197.33 g/mol
Exact Mass197.19
IUPAC NameN-(2,2,3,3-tetramethylbutyl)-4,5-dihydro-1H-imidazol-2-amine
SMILESCC(C)(C)C(C)(C)CNC1=NCCN1
InChIInChI=1S/C11H23N3/c1-10(2,3)11(4,5)8-14-9-12-6-7-13-9/h6-8H2,1-5H3,(H2,12,13,14)
InChIKeyCPSITOZRXZSGGI-UHFFFAOYSA-N
XLogP1.61
TPSA36.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.33
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4,5-dihydro-1H-imidazol-2-ylamino)-2-methylpropan-2-ol
CID 115618533
N-(2-methyl-2-thiophen-2-ylpropyl)-4,5-dihydro-1H-imidazol-2-amine
CID 115627646
N-prop-2-ynyl-4,5-dihydro-1H-imidazol-2-amine
CID 89121666
1-N-(4,5-dihydro-1H-imidazol-2-yl)propane-1,2-diamine
CID 114401743
1-(4,5-dihydro-1H-imidazol-2-ylamino)propan-2-one
CID 142858674
N-(4,4-dimethylhexyl)-4,5-dihydro-1H-imidazol-2-amine
CID 130344576
N-(4,5-dihydro-1H-imidazol-2-yl)-N'-propan-2-ylethane-1,2-diamine
CID 114401726
N-hexyl-4,5-dihydro-1H-imidazol-2-amine
CID 71402010
3-(4,5-dihydro-1H-imidazol-2-ylamino)-2-methylpropan-1-ol
CID 115601412
N-benzyl-4,5-dihydro-1H-imidazol-2-amine;hydroiodide
CID 126766928
N'-(4,5-dihydro-1H-imidazol-2-yl)propane-1,3-diamine
CID 22594256
N-[2-(4-tert-butylphenyl)-2-methylpropyl]-1,4,5,6-tetrahydropyrimidin-2-amine;hydroiodide
CID 109467637

Frequently Asked Questions

What is the IUPAC name of N-(2,2,3,3-tetramethylbutyl)-4,5-dihydro-1H-imidazol-2-amine?
The IUPAC name of N-(2,2,3,3-tetramethylbutyl)-4,5-dihydro-1H-imidazol-2-amine (CID 127013356) is N-(2,2,3,3-tetramethylbutyl)-4,5-dihydro-1H-imidazol-2-amine.
What is the SMILES notation for N-(2,2,3,3-tetramethylbutyl)-4,5-dihydro-1H-imidazol-2-amine?
The canonical SMILES for N-(2,2,3,3-tetramethylbutyl)-4,5-dihydro-1H-imidazol-2-amine is CC(C)(C)C(C)(C)CNC1=NCCN1.
What is the InChIKey of N-(2,2,3,3-tetramethylbutyl)-4,5-dihydro-1H-imidazol-2-amine?
The InChIKey is CPSITOZRXZSGGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3/c1-10(2,3)11(4,5)8-14-9-12-6-7-13-9/h6-8H2,1-5H3,(H2,12,13,14).
What are the key properties of N-(2,2,3,3-tetramethylbutyl)-4,5-dihydro-1H-imidazol-2-amine?
N-(2,2,3,3-tetramethylbutyl)-4,5-dihydro-1H-imidazol-2-amine has a molecular weight of 197.33 g/mol, XLogP of 1.61, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2,3,3-tetramethylbutyl)-4,5-dihydro-1H-imidazol-2-amine is sourced from PubChem (CID 127013356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).