N-[2-(5-phenyl-1H-imidazol-2-yl)ethyl]propan-2-amine

C14H19N3 — CID 60852746

IUPACN-[2-(5-phenyl-1H-imidazol-2-yl)ethyl]propan-2-amine
SMILESCC(C)NCCc1ncc(-c2ccccc2)[nH]1
InChIInChI=1S/C14H19N3/c1-11(2)15-9-8-14-16-10-13(17-14)12-6-4-3-5-7-12/h3-7,10-11,15H,8-9H2,1-2H3,(H,16,17)
InChIKeyPRXUYGPGQSWADY-UHFFFAOYSA-N
MW229.33 g/mol
LogP2.62
Rot. Bonds5

About N-[2-(5-phenyl-1H-imidazol-2-yl)ethyl]propan-2-amine

N-[2-(5-phenyl-1H-imidazol-2-yl)ethyl]propan-2-amine (PubChem CID 60852746) has the molecular formula C14H19N3 and a molecular weight of 229.33 g/mol. Its IUPAC name is N-[2-(5-phenyl-1H-imidazol-2-yl)ethyl]propan-2-amine.

Molecular Properties

Compound NameN-[2-(5-phenyl-1H-imidazol-2-yl)ethyl]propan-2-amine
PubChem CID60852746
Molecular FormulaC14H19N3
Molecular Weight229.33 g/mol
Exact Mass229.16
IUPAC NameN-[2-(5-phenyl-1H-imidazol-2-yl)ethyl]propan-2-amine
SMILESCC(C)NCCc1ncc(-c2ccccc2)[nH]1
InChIInChI=1S/C14H19N3/c1-11(2)15-9-8-14-16-10-13(17-14)12-6-4-3-5-7-12/h3-7,10-11,15H,8-9H2,1-2H3,(H,16,17)
InChIKeyPRXUYGPGQSWADY-UHFFFAOYSA-N
XLogP2.62
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.33
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-[5-(4-methylphenyl)-1H-imidazol-2-yl]ethyl]propan-2-amine
CID 60852379
N-[2-[5-[4-(2-methylpropyl)phenyl]-1H-imidazol-2-yl]ethyl]propan-2-amine
CID 60852192
N-[2-[5-(4-nitrophenyl)-1H-imidazol-2-yl]ethyl]propan-2-amine
CID 60853279
N-[2-[5-[4-(difluoromethoxy)phenyl]-1H-imidazol-2-yl]ethyl]propan-2-amine
CID 60852920
N-[2-[5-[2-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]ethyl]propan-2-amine
CID 60854007
3-[5-(4-ethylphenyl)-1H-imidazol-2-yl]-N-propan-2-ylpropan-1-amine
CID 60851702
N-[2-[5-(3-methylthiophen-2-yl)-1H-imidazol-2-yl]ethyl]propan-2-amine
CID 63990888
N-methyl-1-(5-phenyl-1H-imidazol-2-yl)methanamine;dihydrochloride
CID 72716194
2-(5-phenyl-1H-imidazol-2-yl)ethanamine;dihydrochloride
CID 13170817
3-[5-(3-methoxyphenyl)-1H-imidazol-2-yl]-N-propan-2-ylpropan-1-amine
CID 60851877
N-[2-(5-phenyl-1H-imidazol-2-yl)ethyl]-6-(propan-2-ylamino)pyridine-3-carboxamide
CID 146091348
N-[2-[5-(2,4-difluorophenyl)-1H-imidazol-2-yl]ethyl]propan-2-amine
CID 60854362

Frequently Asked Questions

What is the IUPAC name of N-[2-(5-phenyl-1H-imidazol-2-yl)ethyl]propan-2-amine?
The IUPAC name of N-[2-(5-phenyl-1H-imidazol-2-yl)ethyl]propan-2-amine (CID 60852746) is N-[2-(5-phenyl-1H-imidazol-2-yl)ethyl]propan-2-amine.
What is the SMILES notation for N-[2-(5-phenyl-1H-imidazol-2-yl)ethyl]propan-2-amine?
The canonical SMILES for N-[2-(5-phenyl-1H-imidazol-2-yl)ethyl]propan-2-amine is CC(C)NCCc1ncc(-c2ccccc2)[nH]1.
What is the InChIKey of N-[2-(5-phenyl-1H-imidazol-2-yl)ethyl]propan-2-amine?
The InChIKey is PRXUYGPGQSWADY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3/c1-11(2)15-9-8-14-16-10-13(17-14)12-6-4-3-5-7-12/h3-7,10-11,15H,8-9H2,1-2H3,(H,16,17).
What are the key properties of N-[2-(5-phenyl-1H-imidazol-2-yl)ethyl]propan-2-amine?
N-[2-(5-phenyl-1H-imidazol-2-yl)ethyl]propan-2-amine has a molecular weight of 229.33 g/mol, XLogP of 2.62, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(5-phenyl-1H-imidazol-2-yl)ethyl]propan-2-amine is sourced from PubChem (CID 60852746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).