1-[5-(4-phenylphenyl)-1H-imidazol-2-yl]propan-2-amine

C18H19N3 — CID 60842314

IUPAC1-[5-(4-phenylphenyl)-1H-imidazol-2-yl]propan-2-amine
SMILESCC(N)Cc1ncc(-c2ccc(-c3ccccc3)cc2)[nH]1
InChIInChI=1S/C18H19N3/c1-13(19)11-18-20-12-17(21-18)16-9-7-15(8-10-16)14-5-3-2-4-6-14/h2-10,12-13H,11,19H2,1H3,(H,20,21)
InChIKeyYJCHNYOYDHKUCF-UHFFFAOYSA-N
MW277.37 g/mol
LogP3.63
Rot. Bonds4

About 1-[5-(4-phenylphenyl)-1H-imidazol-2-yl]propan-2-amine

1-[5-(4-phenylphenyl)-1H-imidazol-2-yl]propan-2-amine (PubChem CID 60842314) has the molecular formula C18H19N3 and a molecular weight of 277.37 g/mol. Its IUPAC name is 1-[5-(4-phenylphenyl)-1H-imidazol-2-yl]propan-2-amine.

Molecular Properties

Compound Name1-[5-(4-phenylphenyl)-1H-imidazol-2-yl]propan-2-amine
PubChem CID60842314
Molecular FormulaC18H19N3
Molecular Weight277.37 g/mol
Exact Mass277.16
IUPAC Name1-[5-(4-phenylphenyl)-1H-imidazol-2-yl]propan-2-amine
SMILESCC(N)Cc1ncc(-c2ccc(-c3ccccc3)cc2)[nH]1
InChIInChI=1S/C18H19N3/c1-13(19)11-18-20-12-17(21-18)16-9-7-15(8-10-16)14-5-3-2-4-6-14/h2-10,12-13H,11,19H2,1H3,(H,20,21)
InChIKeyYJCHNYOYDHKUCF-UHFFFAOYSA-N
XLogP3.63
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 53.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(5-phenyl-1H-imidazol-2-yl)propan-2-amine
CID 60840875
1-(5-naphthalen-2-yl-1H-imidazol-2-yl)propan-2-amine
CID 60842671
1-[5-(3-bromophenyl)-1H-imidazol-2-yl]propan-2-amine
CID 60843198
[5-(4-phenylphenyl)-1H-imidazol-2-yl]methanethiol
CID 116879175
1-[5-(1,3-benzoxazol-6-yl)-1H-imidazol-2-yl]propan-2-amine
CID 116876724
N-methyl-1-(5-phenyl-1H-imidazol-2-yl)methanamine;dihydrochloride
CID 72716194
2-(5-phenyl-1H-imidazol-2-yl)ethanamine;dihydrochloride
CID 13170817
5-(4-phenylphenyl)-2-(phenylsulfanylmethyl)-1H-imidazole
CID 11473346
2-(chloromethyl)-5-phenyl-1H-imidazole;hydrochloride
CID 139644021
2-methyl-3-(5-pyridin-4-yl-1H-imidazol-2-yl)propan-1-amine
CID 116877077
N-[2-(5-phenyl-1H-imidazol-2-yl)ethyl]propan-2-amine
CID 60852746
1-[5-(2-nitrophenyl)-1H-imidazol-2-yl]propan-2-amine
CID 60843194

Frequently Asked Questions

What is the IUPAC name of 1-[5-(4-phenylphenyl)-1H-imidazol-2-yl]propan-2-amine?
The IUPAC name of 1-[5-(4-phenylphenyl)-1H-imidazol-2-yl]propan-2-amine (CID 60842314) is 1-[5-(4-phenylphenyl)-1H-imidazol-2-yl]propan-2-amine.
What is the SMILES notation for 1-[5-(4-phenylphenyl)-1H-imidazol-2-yl]propan-2-amine?
The canonical SMILES for 1-[5-(4-phenylphenyl)-1H-imidazol-2-yl]propan-2-amine is CC(N)Cc1ncc(-c2ccc(-c3ccccc3)cc2)[nH]1.
What is the InChIKey of 1-[5-(4-phenylphenyl)-1H-imidazol-2-yl]propan-2-amine?
The InChIKey is YJCHNYOYDHKUCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3/c1-13(19)11-18-20-12-17(21-18)16-9-7-15(8-10-16)14-5-3-2-4-6-14/h2-10,12-13H,11,19H2,1H3,(H,20,21).
What are the key properties of 1-[5-(4-phenylphenyl)-1H-imidazol-2-yl]propan-2-amine?
1-[5-(4-phenylphenyl)-1H-imidazol-2-yl]propan-2-amine has a molecular weight of 277.37 g/mol, XLogP of 3.63, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(4-phenylphenyl)-1H-imidazol-2-yl]propan-2-amine is sourced from PubChem (CID 60842314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).