4-[5-(4-chloro-2-fluorophenyl)-2-methylpyrido[3,4-b]pyrazin-7-yl]morpholine;2-methylpyridine

C24H23ClFN5O — CID 157045652

IUPAC4-[5-(4-chloro-2-fluorophenyl)-2-methylpyrido[3,4-b]pyrazin-7-yl]morpholine;2-methylpyridine
SMILESCc1ccccn1.Cc1cnc2c(-c3ccc(Cl)cc3F)nc(N3CCOCC3)cc2n1
InChIInChI=1S/C18H16ClFN4O.C6H7N/c1-11-10-21-18-15(22-11)9-16(24-4-6-25-7-5-24)23-17(18)13-3-2-12(19)8-14(13)20;1-6-4-2-3-5-7-6/h2-3,8-10H,4-7H2,1H3;2-5H,1H3
InChIKeyHEIPYCIGMQEVPQ-UHFFFAOYSA-N
MW451.93 g/mol
LogP5.02
Rot. Bonds2

About 4-[5-(4-chloro-2-fluorophenyl)-2-methylpyrido[3,4-b]pyrazin-7-yl]morpholine;2-methylpyridine

4-[5-(4-chloro-2-fluorophenyl)-2-methylpyrido[3,4-b]pyrazin-7-yl]morpholine;2-methylpyridine (PubChem CID 157045652) has the molecular formula C24H23ClFN5O and a molecular weight of 451.93 g/mol. Its IUPAC name is 4-[5-(4-chloro-2-fluorophenyl)-2-methylpyrido[3,4-b]pyrazin-7-yl]morpholine;2-methylpyridine.

Molecular Properties

Compound Name4-[5-(4-chloro-2-fluorophenyl)-2-methylpyrido[3,4-b]pyrazin-7-yl]morpholine;2-methylpyridine
PubChem CID157045652
Molecular FormulaC24H23ClFN5O
Molecular Weight451.93 g/mol
Exact Mass451.16
IUPAC Name4-[5-(4-chloro-2-fluorophenyl)-2-methylpyrido[3,4-b]pyrazin-7-yl]morpholine;2-methylpyridine
SMILESCc1ccccn1.Cc1cnc2c(-c3ccc(Cl)cc3F)nc(N3CCOCC3)cc2n1
InChIInChI=1S/C18H16ClFN4O.C6H7N/c1-11-10-21-18-15(22-11)9-16(24-4-6-25-7-5-24)23-17(18)13-3-2-12(19)8-14(13)20;1-6-4-2-3-5-7-6/h2-3,8-10H,4-7H2,1H3;2-5H,1H3
InChIKeyHEIPYCIGMQEVPQ-UHFFFAOYSA-N
XLogP5.02
TPSA64.03 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500451.93
LogP ≤ 55.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 4-[5-(4-chloro-2-fluorophenyl)-2-methylpyrido[3,4-b]pyrazin-7-yl]morpholine;2-methylpyridine 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

4-[8-(4-chloro-2-fluorophenyl)-3-methylpyrido[2,3-b]pyrazin-6-yl]morpholine
CID 157044800
5-(4-chloro-2-fluorophenyl)-2-methylpyrido[3,4-b]pyrazine;1-methylpyrazole;oxane
CID 157045039
7-chloro-5-(2,4-difluorophenyl)-2-methylpyrido[3,4-b]pyrazine
CID 157044809
(2R)-4-[5-(4-chloro-2-fluorophenyl)-1,6-naphthyridin-7-yl]-2-(1-methylpyrazol-4-yl)morpholine
CID 157044906
4-[6-[4-(5-chloro-3-fluoro-2-pyridinyl)piperazin-1-yl]-2-methylpyrimidin-4-yl]morpholine
CID 165433176
11-(4-chloro-2-fluorophenyl)-13-morpholin-4-yl-3,9,12-triazatetracyclo[8.4.0.03,8.04,6]tetradeca-1(14),8,10,12-tetraen-2-one
CID 177152329
5-(2,4-difluorophenyl)-2,3-dimethylpyrido[3,4-b]pyrazine;2-methylpyridine;oxane
CID 157044854
(2R)-4-[4-(4-chloro-2-fluorophenyl)-7-methylpteridin-2-yl]-2-[(3S)-oxolan-3-yl]morpholine
CID 157045623
4-[4-(4-chloro-2-fluorophenyl)-8-fluoroquinazolin-7-yl]morpholine
CID 175076903
5-(4-chloro-2-fluorophenyl)-2-methyl-7-[(2S,4S)-2-(1-methylpyrazol-4-yl)oxan-4-yl]pyrido[3,4-b]pyrazine
CID 157045194
(2R)-4-[5-(4-chloro-2-fluorophenyl)-2-methyl-1,6-naphthyridin-7-yl]-2-(2,4-dimethyl-3H-pyrazol-4-yl)morpholine
CID 167283974
4-(6-chloro-4-methylquinolin-2-yl)morpholine
CID 1477208

Frequently Asked Questions

What is the IUPAC name of 4-[5-(4-chloro-2-fluorophenyl)-2-methylpyrido[3,4-b]pyrazin-7-yl]morpholine;2-methylpyridine?
The IUPAC name of 4-[5-(4-chloro-2-fluorophenyl)-2-methylpyrido[3,4-b]pyrazin-7-yl]morpholine;2-methylpyridine (CID 157045652) is 4-[5-(4-chloro-2-fluorophenyl)-2-methylpyrido[3,4-b]pyrazin-7-yl]morpholine;2-methylpyridine.
What is the SMILES notation for 4-[5-(4-chloro-2-fluorophenyl)-2-methylpyrido[3,4-b]pyrazin-7-yl]morpholine;2-methylpyridine?
The canonical SMILES for 4-[5-(4-chloro-2-fluorophenyl)-2-methylpyrido[3,4-b]pyrazin-7-yl]morpholine;2-methylpyridine is Cc1ccccn1.Cc1cnc2c(-c3ccc(Cl)cc3F)nc(N3CCOCC3)cc2n1.
What is the InChIKey of 4-[5-(4-chloro-2-fluorophenyl)-2-methylpyrido[3,4-b]pyrazin-7-yl]morpholine;2-methylpyridine?
The InChIKey is HEIPYCIGMQEVPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16ClFN4O.C6H7N/c1-11-10-21-18-15(22-11)9-16(24-4-6-25-7-5-24)23-17(18)13-3-2-12(19)8-14(13)20;1-6-4-2-3-5-7-6/h2-3,8-10H,4-7H2,1H3;2-5H,1H3.
What are the key properties of 4-[5-(4-chloro-2-fluorophenyl)-2-methylpyrido[3,4-b]pyrazin-7-yl]morpholine;2-methylpyridine?
4-[5-(4-chloro-2-fluorophenyl)-2-methylpyrido[3,4-b]pyrazin-7-yl]morpholine;2-methylpyridine has a molecular weight of 451.93 g/mol, XLogP of 5.02, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-(4-chloro-2-fluorophenyl)-2-methylpyrido[3,4-b]pyrazin-7-yl]morpholine;2-methylpyridine is sourced from PubChem (CID 157045652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).