1-(4-chlorophenyl)-5-(1,3-dimethylpyrazol-4-yl)-4,5-dihydroimidazol-2-amine

C14H16ClN5 — CID 83094008

IUPAC1-(4-chlorophenyl)-5-(1,3-dimethylpyrazol-4-yl)-4,5-dihydroimidazol-2-amine
SMILESCc1nn(C)cc1C1CN=C(N)N1c1ccc(Cl)cc1
InChIInChI=1S/C14H16ClN5/c1-9-12(8-19(2)18-9)13-7-17-14(16)20(13)11-5-3-10(15)4-6-11/h3-6,8,13H,7H2,1-2H3,(H2,16,17)
InChIKeyQVFYSYDDABBAMW-UHFFFAOYSA-N
MW289.77 g/mol
LogP2.26
Rot. Bonds2

About 1-(4-chlorophenyl)-5-(1,3-dimethylpyrazol-4-yl)-4,5-dihydroimidazol-2-amine

1-(4-chlorophenyl)-5-(1,3-dimethylpyrazol-4-yl)-4,5-dihydroimidazol-2-amine (PubChem CID 83094008) has the molecular formula C14H16ClN5 and a molecular weight of 289.77 g/mol. Its IUPAC name is 1-(4-chlorophenyl)-5-(1,3-dimethylpyrazol-4-yl)-4,5-dihydroimidazol-2-amine.

Molecular Properties

Compound Name1-(4-chlorophenyl)-5-(1,3-dimethylpyrazol-4-yl)-4,5-dihydroimidazol-2-amine
PubChem CID83094008
Molecular FormulaC14H16ClN5
Molecular Weight289.77 g/mol
Exact Mass289.11
IUPAC Name1-(4-chlorophenyl)-5-(1,3-dimethylpyrazol-4-yl)-4,5-dihydroimidazol-2-amine
SMILESCc1nn(C)cc1C1CN=C(N)N1c1ccc(Cl)cc1
InChIInChI=1S/C14H16ClN5/c1-9-12(8-19(2)18-9)13-7-17-14(16)20(13)11-5-3-10(15)4-6-11/h3-6,8,13H,7H2,1-2H3,(H2,16,17)
InChIKeyQVFYSYDDABBAMW-UHFFFAOYSA-N
XLogP2.26
TPSA59.44 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.77
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-(1,3-dimethylpyrazol-4-yl)-1-(4-methoxyphenyl)-4,5-dihydroimidazol-2-amine
CID 83085160
1-(3-bromo-4-chlorophenyl)-5-(1,3-dimethylpyrazol-4-yl)-4,5-dihydroimidazol-2-amine
CID 83083669
5-(1,3-dimethylpyrazol-4-yl)-1-methyl-4,5-dihydroimidazol-2-amine
CID 83094738
5-(1,3-dimethylpyrazol-4-yl)-1-(2-methylphenyl)-4,5-dihydroimidazol-2-amine
CID 83094007
1,5-bis(4-chlorophenyl)-4,5-dihydroimidazol-2-amine
CID 79521542
1-(4-chlorophenyl)-5-(2,4-difluorophenyl)-4,5-dihydroimidazol-2-amine
CID 79502211
1-(4-chlorophenyl)-5-(3-fluoro-4-methylphenyl)-4,5-dihydroimidazol-2-amine
CID 79501134
5-(2,5-difluorophenyl)-1-(4-fluorophenyl)-4,5-dihydroimidazol-2-amine
CID 79499543
5-(2-chloro-6-fluorophenyl)-1-(4-chlorophenyl)-4,5-dihydroimidazol-2-amine
CID 79502934
5-(5-chloro-2-fluorophenyl)-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine
CID 114867764
5-(3-chlorophenyl)-1-(4-methylphenyl)-4,5-dihydroimidazol-2-amine
CID 79505392
5-(3-bromo-4-fluorophenyl)-1-(4-chlorophenyl)-4,5-dihydroimidazol-2-amine
CID 79501280

Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)-5-(1,3-dimethylpyrazol-4-yl)-4,5-dihydroimidazol-2-amine?
The IUPAC name of 1-(4-chlorophenyl)-5-(1,3-dimethylpyrazol-4-yl)-4,5-dihydroimidazol-2-amine (CID 83094008) is 1-(4-chlorophenyl)-5-(1,3-dimethylpyrazol-4-yl)-4,5-dihydroimidazol-2-amine.
What is the SMILES notation for 1-(4-chlorophenyl)-5-(1,3-dimethylpyrazol-4-yl)-4,5-dihydroimidazol-2-amine?
The canonical SMILES for 1-(4-chlorophenyl)-5-(1,3-dimethylpyrazol-4-yl)-4,5-dihydroimidazol-2-amine is Cc1nn(C)cc1C1CN=C(N)N1c1ccc(Cl)cc1.
What is the InChIKey of 1-(4-chlorophenyl)-5-(1,3-dimethylpyrazol-4-yl)-4,5-dihydroimidazol-2-amine?
The InChIKey is QVFYSYDDABBAMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16ClN5/c1-9-12(8-19(2)18-9)13-7-17-14(16)20(13)11-5-3-10(15)4-6-11/h3-6,8,13H,7H2,1-2H3,(H2,16,17).
What are the key properties of 1-(4-chlorophenyl)-5-(1,3-dimethylpyrazol-4-yl)-4,5-dihydroimidazol-2-amine?
1-(4-chlorophenyl)-5-(1,3-dimethylpyrazol-4-yl)-4,5-dihydroimidazol-2-amine has a molecular weight of 289.77 g/mol, XLogP of 2.26, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)-5-(1,3-dimethylpyrazol-4-yl)-4,5-dihydroimidazol-2-amine is sourced from PubChem (CID 83094008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).