5-phenyl-1H-imidazol-2-amine;propane

C12H17N3 — CID 143872640

IUPAC5-phenyl-1H-imidazol-2-amine;propane
SMILESCCC.Nc1ncc(-c2ccccc2)[nH]1
InChIInChI=1S/C9H9N3.C3H8/c10-9-11-6-8(12-9)7-4-2-1-3-5-7;1-3-2/h1-6H,(H3,10,11,12);3H2,1-2H3
InChIKeySXVMSYATCWQLOA-UHFFFAOYSA-N
MW203.29 g/mol
LogP3.08
Rot. Bonds1

About 5-phenyl-1H-imidazol-2-amine;propane

5-phenyl-1H-imidazol-2-amine;propane (PubChem CID 143872640) has the molecular formula C12H17N3 and a molecular weight of 203.29 g/mol. Its IUPAC name is 5-phenyl-1H-imidazol-2-amine;propane.

Molecular Properties

Compound Name5-phenyl-1H-imidazol-2-amine;propane
PubChem CID143872640
Molecular FormulaC12H17N3
Molecular Weight203.29 g/mol
Exact Mass203.14
IUPAC Name5-phenyl-1H-imidazol-2-amine;propane
SMILESCCC.Nc1ncc(-c2ccccc2)[nH]1
InChIInChI=1S/C9H9N3.C3H8/c10-9-11-6-8(12-9)7-4-2-1-3-5-7;1-3-2/h1-6H,(H3,10,11,12);3H2,1-2H3
InChIKeySXVMSYATCWQLOA-UHFFFAOYSA-N
XLogP3.08
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.29
LogP ≤ 53.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

copper(1+);5-phenyl-1H-imidazol-2-amine;iodide
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5-(4-phenoxyphenyl)-1H-imidazol-2-amine
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5-(3-methylphenyl)-1H-imidazol-2-amine
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CID 66202105
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2-(5-phenyl-1H-imidazol-2-yl)butan-1-amine
CID 65233105
4-(2-amino-1H-imidazol-5-yl)benzoic acid;hydrochloride
CID 69483664
1-(5-phenyl-1H-imidazol-2-yl)propan-2-amine
CID 60840875
5-(4-ethoxy-3-fluorophenyl)-1H-imidazol-2-amine
CID 82286480
(1S)-1-(5-phenyl-1H-imidazol-2-yl)pentan-1-amine
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1-[5-(4-phenylphenyl)-1H-imidazol-2-yl]propan-2-amine
CID 60842314

Frequently Asked Questions

What is the IUPAC name of 5-phenyl-1H-imidazol-2-amine;propane?
The IUPAC name of 5-phenyl-1H-imidazol-2-amine;propane (CID 143872640) is 5-phenyl-1H-imidazol-2-amine;propane.
What is the SMILES notation for 5-phenyl-1H-imidazol-2-amine;propane?
The canonical SMILES for 5-phenyl-1H-imidazol-2-amine;propane is CCC.Nc1ncc(-c2ccccc2)[nH]1.
What is the InChIKey of 5-phenyl-1H-imidazol-2-amine;propane?
The InChIKey is SXVMSYATCWQLOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3.C3H8/c10-9-11-6-8(12-9)7-4-2-1-3-5-7;1-3-2/h1-6H,(H3,10,11,12);3H2,1-2H3.
What are the key properties of 5-phenyl-1H-imidazol-2-amine;propane?
5-phenyl-1H-imidazol-2-amine;propane has a molecular weight of 203.29 g/mol, XLogP of 3.08, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenyl-1H-imidazol-2-amine;propane is sourced from PubChem (CID 143872640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).