(2R)-3-tert-butyl-2-methyl-1-phenyl-2H-imidazo[4,5-b]pyrazine

C16H20N4 — CID 155603202

IUPAC(2R)-3-tert-butyl-2-methyl-1-phenyl-2H-imidazo[4,5-b]pyrazine
SMILESC[C@H]1N(c2ccccc2)c2nccnc2N1C(C)(C)C
InChIInChI=1S/C16H20N4/c1-12-19(13-8-6-5-7-9-13)14-15(18-11-10-17-14)20(12)16(2,3)4/h5-12H,1-4H3/t12-/m0/s1
InChIKeyDDTFTWKBMLYCDP-LBPRGKRZSA-N
MW268.36 g/mol
LogP3.58
Rot. Bonds1

About (2R)-3-tert-butyl-2-methyl-1-phenyl-2H-imidazo[4,5-b]pyrazine

(2R)-3-tert-butyl-2-methyl-1-phenyl-2H-imidazo[4,5-b]pyrazine (PubChem CID 155603202) has the molecular formula C16H20N4 and a molecular weight of 268.36 g/mol. Its IUPAC name is (2R)-3-tert-butyl-2-methyl-1-phenyl-2H-imidazo[4,5-b]pyrazine.

Molecular Properties

Compound Name(2R)-3-tert-butyl-2-methyl-1-phenyl-2H-imidazo[4,5-b]pyrazine
PubChem CID155603202
Molecular FormulaC16H20N4
Molecular Weight268.36 g/mol
Exact Mass268.17
IUPAC Name(2R)-3-tert-butyl-2-methyl-1-phenyl-2H-imidazo[4,5-b]pyrazine
SMILESC[C@H]1N(c2ccccc2)c2nccnc2N1C(C)(C)C
InChIInChI=1S/C16H20N4/c1-12-19(13-8-6-5-7-9-13)14-15(18-11-10-17-14)20(12)16(2,3)4/h5-12H,1-4H3/t12-/m0/s1
InChIKeyDDTFTWKBMLYCDP-LBPRGKRZSA-N
XLogP3.58
TPSA32.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 53.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze (2R)-3-tert-butyl-2-methyl-1-phenyl-2H-imidazo[4,5-b]pyrazine 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

(2R)-3-tert-butyl-2-methyl-1-(6-methylcyclohexa-1,3-dien-1-yl)-2H-imidazo[4,5-b]pyrazine
CID 155073907
10,10-dimethyl-8-phenyl-1,3,6,8-tetrazatetracyclo[7.7.0.02,7.011,16]hexadeca-2,4,6,11,13,15-hexaene
CID 144782319
(2R)-3-tert-butyl-2-methyl-1-phenyl-2H-imidazo[4,5-b]pyrazine;(2R)-1-tert-butyl-2-methyl-3-phenyl-2H-imidazo[4,5-b]pyridine;(2S)-3-tert-butyl-2-methyl-1-phenyl-2H-imidazo[4,5-b]pyridine;(5S)-1-tert-butyl-2,2,4,4,5-pentamethylpyrrolidine;(1S)-2-tert-butyl-1,3,3-trimethyl-2-azaspiro[4.5]decane;(2R)-3,5-ditert-butyl-2-methyl-1-phenyl-2H-benzimidazole;methane
CID 157498133
3-(3,5-dimethylphenyl)-2-methyl-1-(2-methylphenyl)-2H-imidazo[4,5-b]pyrazine
CID 121403727
ethene;10,10,14-trimethyl-8-phenyl-1,3,6,8-tetrazatetracyclo[7.7.0.02,7.011,16]hexadeca-2,4,6,11(16),12,14-hexaene
CID 144782442
2,4,5-trimethyl-1,3-diphenyl-2H-imidazole
CID 126693775
2-ethoxy-1-phenyl-3-(2-phenylphenyl)-2H-imidazo[4,5-b]pyrazine
CID 118429258
11-phenyl-1,11,13,16-tetrazatetracyclo[8.7.0.02,7.012,17]heptadeca-2,4,6,8,12,14,16-heptaene
CID 123210659
(10R)-8-fluoro-8,9,9-trimethyl-11-phenyl-1,11,13,16-tetrazatetracyclo[8.7.0.02,7.012,17]heptadeca-2,4,6,12,14,16-hexaene
CID 144724858
3-(4-tert-butylphenyl)-1-phenyl-2H-imidazo[4,5-b]pyrazine
CID 140758604
4-bromo-8,9-dimethyl-11-phenyl-1,11,13,16-tetrazatetracyclo[8.7.0.02,7.012,17]heptadeca-2(7),3,5,12,14,16-hexaene
CID 144782447
chloromethane;3-ethyl-2-methylhexane;2-methyl-1,3-diphenyl-2H-imidazo[4,5-b]pyridine
CID 145012582

Frequently Asked Questions

What is the IUPAC name of (2R)-3-tert-butyl-2-methyl-1-phenyl-2H-imidazo[4,5-b]pyrazine?
The IUPAC name of (2R)-3-tert-butyl-2-methyl-1-phenyl-2H-imidazo[4,5-b]pyrazine (CID 155603202) is (2R)-3-tert-butyl-2-methyl-1-phenyl-2H-imidazo[4,5-b]pyrazine.
What is the SMILES notation for (2R)-3-tert-butyl-2-methyl-1-phenyl-2H-imidazo[4,5-b]pyrazine?
The canonical SMILES for (2R)-3-tert-butyl-2-methyl-1-phenyl-2H-imidazo[4,5-b]pyrazine is C[C@H]1N(c2ccccc2)c2nccnc2N1C(C)(C)C.
What is the InChIKey of (2R)-3-tert-butyl-2-methyl-1-phenyl-2H-imidazo[4,5-b]pyrazine?
The InChIKey is DDTFTWKBMLYCDP-LBPRGKRZSA-N. The full InChI is InChI=1S/C16H20N4/c1-12-19(13-8-6-5-7-9-13)14-15(18-11-10-17-14)20(12)16(2,3)4/h5-12H,1-4H3/t12-/m0/s1.
What are the key properties of (2R)-3-tert-butyl-2-methyl-1-phenyl-2H-imidazo[4,5-b]pyrazine?
(2R)-3-tert-butyl-2-methyl-1-phenyl-2H-imidazo[4,5-b]pyrazine has a molecular weight of 268.36 g/mol, XLogP of 3.58, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-3-tert-butyl-2-methyl-1-phenyl-2H-imidazo[4,5-b]pyrazine is sourced from PubChem (CID 155603202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).