4-(4,5-dihydro-1H-imidazol-2-yl)-5-ethyl-2-[1-[(2-fluorophenyl)methyl]pyrazol-3-yl]pyrimidine

C19H19FN6 — CID 91149613

IUPAC4-(4,5-dihydro-1H-imidazol-2-yl)-5-ethyl-2-[1-[(2-fluorophenyl)methyl]pyrazol-3-yl]pyrimidine
SMILESCCc1cnc(-c2ccn(Cc3ccccc3F)n2)nc1C1=NCCN1
InChIInChI=1S/C19H19FN6/c1-2-13-11-23-18(24-17(13)19-21-8-9-22-19)16-7-10-26(25-16)12-14-5-3-4-6-15(14)20/h3-7,10-11H,2,8-9,12H2,1H3,(H,21,22)
InChIKeyMUEYXBFMWLKSAY-UHFFFAOYSA-N
MW350.40 g/mol
LogP2.44
Rot. Bonds5

About 4-(4,5-dihydro-1H-imidazol-2-yl)-5-ethyl-2-[1-[(2-fluorophenyl)methyl]pyrazol-3-yl]pyrimidine

4-(4,5-dihydro-1H-imidazol-2-yl)-5-ethyl-2-[1-[(2-fluorophenyl)methyl]pyrazol-3-yl]pyrimidine (PubChem CID 91149613) has the molecular formula C19H19FN6 and a molecular weight of 350.40 g/mol. Its IUPAC name is 4-(4,5-dihydro-1H-imidazol-2-yl)-5-ethyl-2-[1-[(2-fluorophenyl)methyl]pyrazol-3-yl]pyrimidine.

Molecular Properties

Compound Name4-(4,5-dihydro-1H-imidazol-2-yl)-5-ethyl-2-[1-[(2-fluorophenyl)methyl]pyrazol-3-yl]pyrimidine
PubChem CID91149613
Molecular FormulaC19H19FN6
Molecular Weight350.40 g/mol
Exact Mass350.17
IUPAC Name4-(4,5-dihydro-1H-imidazol-2-yl)-5-ethyl-2-[1-[(2-fluorophenyl)methyl]pyrazol-3-yl]pyrimidine
SMILESCCc1cnc(-c2ccn(Cc3ccccc3F)n2)nc1C1=NCCN1
InChIInChI=1S/C19H19FN6/c1-2-13-11-23-18(24-17(13)19-21-8-9-22-19)16-7-10-26(25-16)12-14-5-3-4-6-15(14)20/h3-7,10-11H,2,8-9,12H2,1H3,(H,21,22)
InChIKeyMUEYXBFMWLKSAY-UHFFFAOYSA-N
XLogP2.44
TPSA67.99 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.40
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 4-(4,5-dihydro-1H-imidazol-2-yl)-5-ethyl-2-[1-[(2-fluorophenyl)methyl]pyrazol-3-yl]pyrimidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-ethyl-2-[1-[(2-fluorophenyl)methyl]pyrazol-3-yl]-4-methylsulfinylpyrimidine
CID 90722088
2-[1-[(2-fluorophenyl)methyl]pyrazol-3-yl]-5-methylsulfonylpyrimidin-4-amine
CID 91337023
5-cyclopropyl-N-(ethoxymethyl)-2-[1-[(2-fluorophenyl)methyl]pyrazol-3-yl]pyrimidin-4-amine
CID 90991851
4-chloro-5-fluoro-2-[1-[(2-fluorophenyl)methyl]pyrazol-3-yl]-6-methoxypyrimidine
CID 141427956
2-[1-[(2-fluorophenyl)methyl]pyrazol-3-yl]-4,5,5-trimethyl-7H-pyrrolo[2,3-d]pyrimidin-6-one
CID 118969741
2-[1-[(2-fluorophenyl)methyl]pyrazol-3-yl]-4-methoxy-5,5-dimethyl-7H-pyrrolo[2,3-d]pyrimidin-6-one
CID 118969658
N-butyl-5-fluoro-2-[1-[(2-fluorophenyl)methyl]-5-(2H-pyrrol-5-yl)pyrazol-3-yl]pyrimidin-4-amine
CID 145046937
N-benzyl-5-[1-[(2-fluorophenyl)methyl]pyrazol-3-yl]-4-methyl-1,3-thiazol-2-amine
CID 42210415
N,N-diethyl-5-[(2-fluorophenyl)methyl]-2-pyridin-2-ylpyrimidin-4-amine
CID 51042444
1-[(2-fluorophenyl)methyl]-3-(trifluoromethyl)pyrazole
CID 52751123
5-fluoro-2-[1-[(2-fluorophenyl)methyl]-5-methylpyrazol-3-yl]-N-methyl-N-[(1-methylcyclopropyl)methyl]pyrimidin-4-amine
CID 144886537
1-[1-[(2-fluorophenyl)methyl]-3-[5-fluoro-4-[3-(trifluoromethyl)piperazin-1-yl]pyrimidin-2-yl]pyrazol-5-yl]ethanone
CID 118233328

Frequently Asked Questions

What is the IUPAC name of 4-(4,5-dihydro-1H-imidazol-2-yl)-5-ethyl-2-[1-[(2-fluorophenyl)methyl]pyrazol-3-yl]pyrimidine?
The IUPAC name of 4-(4,5-dihydro-1H-imidazol-2-yl)-5-ethyl-2-[1-[(2-fluorophenyl)methyl]pyrazol-3-yl]pyrimidine (CID 91149613) is 4-(4,5-dihydro-1H-imidazol-2-yl)-5-ethyl-2-[1-[(2-fluorophenyl)methyl]pyrazol-3-yl]pyrimidine.
What is the SMILES notation for 4-(4,5-dihydro-1H-imidazol-2-yl)-5-ethyl-2-[1-[(2-fluorophenyl)methyl]pyrazol-3-yl]pyrimidine?
The canonical SMILES for 4-(4,5-dihydro-1H-imidazol-2-yl)-5-ethyl-2-[1-[(2-fluorophenyl)methyl]pyrazol-3-yl]pyrimidine is CCc1cnc(-c2ccn(Cc3ccccc3F)n2)nc1C1=NCCN1.
What is the InChIKey of 4-(4,5-dihydro-1H-imidazol-2-yl)-5-ethyl-2-[1-[(2-fluorophenyl)methyl]pyrazol-3-yl]pyrimidine?
The InChIKey is MUEYXBFMWLKSAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19FN6/c1-2-13-11-23-18(24-17(13)19-21-8-9-22-19)16-7-10-26(25-16)12-14-5-3-4-6-15(14)20/h3-7,10-11H,2,8-9,12H2,1H3,(H,21,22).
What are the key properties of 4-(4,5-dihydro-1H-imidazol-2-yl)-5-ethyl-2-[1-[(2-fluorophenyl)methyl]pyrazol-3-yl]pyrimidine?
4-(4,5-dihydro-1H-imidazol-2-yl)-5-ethyl-2-[1-[(2-fluorophenyl)methyl]pyrazol-3-yl]pyrimidine has a molecular weight of 350.40 g/mol, XLogP of 2.44, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4,5-dihydro-1H-imidazol-2-yl)-5-ethyl-2-[1-[(2-fluorophenyl)methyl]pyrazol-3-yl]pyrimidine is sourced from PubChem (CID 91149613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).