(1R)-3-phenyl-1-[5-(4-phenylphenyl)-1H-imidazol-2-yl]propan-1-amine;hydrochloride

C24H24ClN3 — CID 159178971

IUPAC(1R)-3-phenyl-1-[5-(4-phenylphenyl)-1H-imidazol-2-yl]propan-1-amine;hydrochloride
SMILESCl.N[C@H](CCc1ccccc1)c1ncc(-c2ccc(-c3ccccc3)cc2)[nH]1
InChIInChI=1S/C24H23N3.ClH/c25-22(16-11-18-7-3-1-4-8-18)24-26-17-23(27-24)21-14-12-20(13-15-21)19-9-5-2-6-10-19;/h1-10,12-15,17,22H,11,16,25H2,(H,26,27);1H/t22-;/m1./s1
InChIKeyKMQIBZIOFOAQGF-VZYDHVRKSA-N
MW389.93 g/mol
LogP5.80
Rot. Bonds6

About (1R)-3-phenyl-1-[5-(4-phenylphenyl)-1H-imidazol-2-yl]propan-1-amine;hydrochloride

(1R)-3-phenyl-1-[5-(4-phenylphenyl)-1H-imidazol-2-yl]propan-1-amine;hydrochloride (PubChem CID 159178971) has the molecular formula C24H24ClN3 and a molecular weight of 389.93 g/mol. Its IUPAC name is (1R)-3-phenyl-1-[5-(4-phenylphenyl)-1H-imidazol-2-yl]propan-1-amine;hydrochloride.

Molecular Properties

Compound Name(1R)-3-phenyl-1-[5-(4-phenylphenyl)-1H-imidazol-2-yl]propan-1-amine;hydrochloride
PubChem CID159178971
Molecular FormulaC24H24ClN3
Molecular Weight389.93 g/mol
Exact Mass389.17
IUPAC Name(1R)-3-phenyl-1-[5-(4-phenylphenyl)-1H-imidazol-2-yl]propan-1-amine;hydrochloride
SMILESCl.N[C@H](CCc1ccccc1)c1ncc(-c2ccc(-c3ccccc3)cc2)[nH]1
InChIInChI=1S/C24H23N3.ClH/c25-22(16-11-18-7-3-1-4-8-18)24-26-17-23(27-24)21-14-12-20(13-15-21)19-9-5-2-6-10-19;/h1-10,12-15,17,22H,11,16,25H2,(H,26,27);1H/t22-;/m1./s1
InChIKeyKMQIBZIOFOAQGF-VZYDHVRKSA-N
XLogP5.80
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500389.93
LogP ≤ 55.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(1S)-1-(5-phenyl-1H-imidazol-2-yl)pentan-1-amine
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(S)-phenyl-(5-phenyl-1H-imidazol-2-yl)methanamine
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[5-(4-phenylphenyl)-1H-imidazol-2-yl]methanethiol
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azane;5-phenyl-2-(3-phenylpropyl)-1H-imidazole
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2-(5-phenyl-1H-imidazol-2-yl)butan-1-amine
CID 65233105
1-[5-(4-phenylphenyl)-1H-imidazol-2-yl]propan-2-amine
CID 60842314
1-[5-(4-tert-butylphenyl)-1H-imidazol-2-yl]-3-methoxypropan-1-amine
CID 62477508
2-amino-2-[5-(4-chlorophenyl)-1H-imidazol-2-yl]ethanol
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1-[5-(4-methylsulfonylphenyl)-1H-imidazol-2-yl]butan-1-amine
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3-amino-3-[5-(4-ethylphenyl)-1H-imidazol-2-yl]propanoic acid
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Frequently Asked Questions

What is the IUPAC name of (1R)-3-phenyl-1-[5-(4-phenylphenyl)-1H-imidazol-2-yl]propan-1-amine;hydrochloride?
The IUPAC name of (1R)-3-phenyl-1-[5-(4-phenylphenyl)-1H-imidazol-2-yl]propan-1-amine;hydrochloride (CID 159178971) is (1R)-3-phenyl-1-[5-(4-phenylphenyl)-1H-imidazol-2-yl]propan-1-amine;hydrochloride.
What is the SMILES notation for (1R)-3-phenyl-1-[5-(4-phenylphenyl)-1H-imidazol-2-yl]propan-1-amine;hydrochloride?
The canonical SMILES for (1R)-3-phenyl-1-[5-(4-phenylphenyl)-1H-imidazol-2-yl]propan-1-amine;hydrochloride is Cl.N[C@H](CCc1ccccc1)c1ncc(-c2ccc(-c3ccccc3)cc2)[nH]1.
What is the InChIKey of (1R)-3-phenyl-1-[5-(4-phenylphenyl)-1H-imidazol-2-yl]propan-1-amine;hydrochloride?
The InChIKey is KMQIBZIOFOAQGF-VZYDHVRKSA-N. The full InChI is InChI=1S/C24H23N3.ClH/c25-22(16-11-18-7-3-1-4-8-18)24-26-17-23(27-24)21-14-12-20(13-15-21)19-9-5-2-6-10-19;/h1-10,12-15,17,22H,11,16,25H2,(H,26,27);1H/t22-;/m1./s1.
What are the key properties of (1R)-3-phenyl-1-[5-(4-phenylphenyl)-1H-imidazol-2-yl]propan-1-amine;hydrochloride?
(1R)-3-phenyl-1-[5-(4-phenylphenyl)-1H-imidazol-2-yl]propan-1-amine;hydrochloride has a molecular weight of 389.93 g/mol, XLogP of 5.80, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-3-phenyl-1-[5-(4-phenylphenyl)-1H-imidazol-2-yl]propan-1-amine;hydrochloride is sourced from PubChem (CID 159178971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).