N,N-diethyl-1-phenylimidazol-4-amine

C13H17N3 — CID 175089225

IUPACN,N-diethyl-1-phenylimidazol-4-amine
SMILESCCN(CC)c1cn(-c2ccccc2)cn1
InChIInChI=1S/C13H17N3/c1-3-15(4-2)13-10-16(11-14-13)12-8-6-5-7-9-12/h5-11H,3-4H2,1-2H3
InChIKeyLZPXQQFXHDNVPP-UHFFFAOYSA-N
MW215.30 g/mol
LogP2.72
Rot. Bonds4

About N,N-diethyl-1-phenylimidazol-4-amine

N,N-diethyl-1-phenylimidazol-4-amine (PubChem CID 175089225) has the molecular formula C13H17N3 and a molecular weight of 215.30 g/mol. Its IUPAC name is N,N-diethyl-1-phenylimidazol-4-amine.

Molecular Properties

Compound NameN,N-diethyl-1-phenylimidazol-4-amine
PubChem CID175089225
Molecular FormulaC13H17N3
Molecular Weight215.30 g/mol
Exact Mass215.14
IUPAC NameN,N-diethyl-1-phenylimidazol-4-amine
SMILESCCN(CC)c1cn(-c2ccccc2)cn1
InChIInChI=1S/C13H17N3/c1-3-15(4-2)13-10-16(11-14-13)12-8-6-5-7-9-12/h5-11H,3-4H2,1-2H3
InChIKeyLZPXQQFXHDNVPP-UHFFFAOYSA-N
XLogP2.72
TPSA21.06 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 52.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-1-phenylimidazol-4-amine?
The IUPAC name of N,N-diethyl-1-phenylimidazol-4-amine (CID 175089225) is N,N-diethyl-1-phenylimidazol-4-amine.
What is the SMILES notation for N,N-diethyl-1-phenylimidazol-4-amine?
The canonical SMILES for N,N-diethyl-1-phenylimidazol-4-amine is CCN(CC)c1cn(-c2ccccc2)cn1.
What is the InChIKey of N,N-diethyl-1-phenylimidazol-4-amine?
The InChIKey is LZPXQQFXHDNVPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3/c1-3-15(4-2)13-10-16(11-14-13)12-8-6-5-7-9-12/h5-11H,3-4H2,1-2H3.
What are the key properties of N,N-diethyl-1-phenylimidazol-4-amine?
N,N-diethyl-1-phenylimidazol-4-amine has a molecular weight of 215.30 g/mol, XLogP of 2.72, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-1-phenylimidazol-4-amine is sourced from PubChem (CID 175089225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).