N-phenyl-1-[1-(1,3-thiazol-2-yl)propyl]imidazol-2-amine

C15H16N4S — CID 106574962

IUPACN-phenyl-1-[1-(1,3-thiazol-2-yl)propyl]imidazol-2-amine
SMILESCCC(c1nccs1)n1ccnc1Nc1ccccc1
InChIInChI=1S/C15H16N4S/c1-2-13(14-16-9-11-20-14)19-10-8-17-15(19)18-12-6-4-3-5-7-12/h3-11,13H,2H2,1H3,(H,17,18)
InChIKeyOKFBXJKDUFMGHB-UHFFFAOYSA-N
MW284.39 g/mol
LogP4.08
Rot. Bonds5

About N-phenyl-1-[1-(1,3-thiazol-2-yl)propyl]imidazol-2-amine

N-phenyl-1-[1-(1,3-thiazol-2-yl)propyl]imidazol-2-amine (PubChem CID 106574962) has the molecular formula C15H16N4S and a molecular weight of 284.39 g/mol. Its IUPAC name is N-phenyl-1-[1-(1,3-thiazol-2-yl)propyl]imidazol-2-amine.

Molecular Properties

Compound NameN-phenyl-1-[1-(1,3-thiazol-2-yl)propyl]imidazol-2-amine
PubChem CID106574962
Molecular FormulaC15H16N4S
Molecular Weight284.39 g/mol
Exact Mass284.11
IUPAC NameN-phenyl-1-[1-(1,3-thiazol-2-yl)propyl]imidazol-2-amine
SMILESCCC(c1nccs1)n1ccnc1Nc1ccccc1
InChIInChI=1S/C15H16N4S/c1-2-13(14-16-9-11-20-14)19-10-8-17-15(19)18-12-6-4-3-5-7-12/h3-11,13H,2H2,1H3,(H,17,18)
InChIKeyOKFBXJKDUFMGHB-UHFFFAOYSA-N
XLogP4.08
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.39
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(1-imidazol-1-ylpropan-2-yl)-N-phenylimidazol-2-amine
CID 106568029
N-(4-ethoxyphenyl)-1-propan-2-ylimidazol-2-amine
CID 106555751
1-[1-(2-fluorophenyl)ethyl]-N-phenylimidazol-2-amine
CID 106564561
(2R)-N-[(S)-phenyl(1,3-thiazol-2-yl)methyl]butan-2-amine
CID 124570142
1-octyl-N-phenylimidazol-2-amine
CID 106578848
N-phenyl-1-(2-pyrrolidin-1-ylpropyl)imidazol-2-amine
CID 106577771
1-(2-ethoxyethyl)-N-phenylimidazol-2-amine
CID 106554048
1-(2-methoxypropyl)-N-phenylimidazol-2-amine
CID 106583404
1-propan-2-yl-N-(4-propan-2-yloxyphenyl)imidazol-2-amine
CID 106560811
2-[1-(2-methyl-5-phenylpiperazin-1-yl)propyl]-1,3-thiazole
CID 64941668
4-methyl-N-prop-2-enyl-1-[1-(1,3-thiazol-2-yl)propyl]imidazol-2-amine
CID 106574986
N-phenyl-1-(2-piperidin-1-ylpropyl)imidazol-2-amine
CID 106567928

Frequently Asked Questions

What is the IUPAC name of N-phenyl-1-[1-(1,3-thiazol-2-yl)propyl]imidazol-2-amine?
The IUPAC name of N-phenyl-1-[1-(1,3-thiazol-2-yl)propyl]imidazol-2-amine (CID 106574962) is N-phenyl-1-[1-(1,3-thiazol-2-yl)propyl]imidazol-2-amine.
What is the SMILES notation for N-phenyl-1-[1-(1,3-thiazol-2-yl)propyl]imidazol-2-amine?
The canonical SMILES for N-phenyl-1-[1-(1,3-thiazol-2-yl)propyl]imidazol-2-amine is CCC(c1nccs1)n1ccnc1Nc1ccccc1.
What is the InChIKey of N-phenyl-1-[1-(1,3-thiazol-2-yl)propyl]imidazol-2-amine?
The InChIKey is OKFBXJKDUFMGHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4S/c1-2-13(14-16-9-11-20-14)19-10-8-17-15(19)18-12-6-4-3-5-7-12/h3-11,13H,2H2,1H3,(H,17,18).
What are the key properties of N-phenyl-1-[1-(1,3-thiazol-2-yl)propyl]imidazol-2-amine?
N-phenyl-1-[1-(1,3-thiazol-2-yl)propyl]imidazol-2-amine has a molecular weight of 284.39 g/mol, XLogP of 4.08, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-1-[1-(1,3-thiazol-2-yl)propyl]imidazol-2-amine is sourced from PubChem (CID 106574962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).