2-[3-[3-(5-methoxy-3-pyridinyl)pyrazin-2-yl]azetidin-1-yl]quinoline

C22H19N5O — CID 58547505

IUPAC2-[3-[3-(5-methoxy-3-pyridinyl)pyrazin-2-yl]azetidin-1-yl]quinoline
SMILESCOc1cncc(-c2nccnc2C2CN(c3ccc4ccccc4n3)C2)c1
InChIInChI=1S/C22H19N5O/c1-28-18-10-16(11-23-12-18)21-22(25-9-8-24-21)17-13-27(14-17)20-7-6-15-4-2-3-5-19(15)26-20/h2-12,17H,13-14H2,1H3
InChIKeyIQAPZWWGXDDWNB-UHFFFAOYSA-N
MW369.43 g/mol
LogP3.70
Rot. Bonds4

About 2-[3-[3-(5-methoxy-3-pyridinyl)pyrazin-2-yl]azetidin-1-yl]quinoline

2-[3-[3-(5-methoxy-3-pyridinyl)pyrazin-2-yl]azetidin-1-yl]quinoline (PubChem CID 58547505) has the molecular formula C22H19N5O and a molecular weight of 369.43 g/mol. Its IUPAC name is 2-[3-[3-(5-methoxy-3-pyridinyl)pyrazin-2-yl]azetidin-1-yl]quinoline.

Molecular Properties

Compound Name2-[3-[3-(5-methoxy-3-pyridinyl)pyrazin-2-yl]azetidin-1-yl]quinoline
PubChem CID58547505
Molecular FormulaC22H19N5O
Molecular Weight369.43 g/mol
Exact Mass369.16
IUPAC Name2-[3-[3-(5-methoxy-3-pyridinyl)pyrazin-2-yl]azetidin-1-yl]quinoline
SMILESCOc1cncc(-c2nccnc2C2CN(c3ccc4ccccc4n3)C2)c1
InChIInChI=1S/C22H19N5O/c1-28-18-10-16(11-23-12-18)21-22(25-9-8-24-21)17-13-27(14-17)20-7-6-15-4-2-3-5-19(15)26-20/h2-12,17H,13-14H2,1H3
InChIKeyIQAPZWWGXDDWNB-UHFFFAOYSA-N
XLogP3.70
TPSA64.03 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.43
LogP ≤ 53.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

N(2)-[3-methoxy-4-(morpholin-4-yl)phenyl]-N(4)-(quinolin-3-yl)pyrimidine-2,4-diamine
CID 10202829
4-(5,6-Dimethyl-2-pyridin-2-yl-pyridin-3-yl)oxy-N-(3-methoxyphenyl)pyridin-2-amine
CID 44521021
4-[4-(4-Methoxyphenyl)piperazin-1-Yl]-2-(Pyridin-2-Yl)quinazoline
CID 58279815
2-chloro-4-(6-methoxy-3,4-dihydroquinolin-1(2H)-yl)pyrido[3,2-d]pyrimidine
CID 134611709
2-[4-(2-Methyl-5-pyridin-4-yl-pyrimidin-4-yl)-phenoxymethyl]-quinoline
CID 11495114
2-(5-Methoxy-3-pyridinyl)-6-(4-pyridin-4-ylpiperazin-1-yl)pyrazine
CID 45488325
N2-(3-methoxyphenyl)-N4-(quinolin-3-yl)pyrimidine-2,4-diamine
CID 9902671
8-methoxy-2-methyl-1-(2-[4-(4-methylpyridin-2-yl)piperazin-1-yl]ethyl}-5,6-dihydro-4H-pyrrolo[3,2,1-ij]quinoline
CID 10386517
2-(4-methoxy-phenyl)-1-{2-[4-(4-methylpyridin-2-yl)piperazin-1-yl]ethyl}-5,6-dihydro-4H-pyrrolo[3,2,1-ij]quinoline
CID 10389831
4-Quinazolinamine, N-(6-methoxy-3-pyridinyl)-N,2-dimethyl-
CID 11529244
4-Quinazolinamine, N-(5-methoxy-2-pyridinyl)-N,2-dimethyl-
CID 11666313
1-[4-[3-(1-Quinolin-2-ylazetidin-3-yl)oxypyrazin-2-yl]piperidin-1-yl]ethanone
CID 54670110

Frequently Asked Questions

What is the IUPAC name of 2-[3-[3-(5-methoxy-3-pyridinyl)pyrazin-2-yl]azetidin-1-yl]quinoline?
The IUPAC name of 2-[3-[3-(5-methoxy-3-pyridinyl)pyrazin-2-yl]azetidin-1-yl]quinoline (CID 58547505) is 2-[3-[3-(5-methoxy-3-pyridinyl)pyrazin-2-yl]azetidin-1-yl]quinoline.
What is the SMILES notation for 2-[3-[3-(5-methoxy-3-pyridinyl)pyrazin-2-yl]azetidin-1-yl]quinoline?
The canonical SMILES for 2-[3-[3-(5-methoxy-3-pyridinyl)pyrazin-2-yl]azetidin-1-yl]quinoline is COc1cncc(-c2nccnc2C2CN(c3ccc4ccccc4n3)C2)c1.
What is the InChIKey of 2-[3-[3-(5-methoxy-3-pyridinyl)pyrazin-2-yl]azetidin-1-yl]quinoline?
The InChIKey is IQAPZWWGXDDWNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N5O/c1-28-18-10-16(11-23-12-18)21-22(25-9-8-24-21)17-13-27(14-17)20-7-6-15-4-2-3-5-19(15)26-20/h2-12,17H,13-14H2,1H3.
What are the key properties of 2-[3-[3-(5-methoxy-3-pyridinyl)pyrazin-2-yl]azetidin-1-yl]quinoline?
2-[3-[3-(5-methoxy-3-pyridinyl)pyrazin-2-yl]azetidin-1-yl]quinoline has a molecular weight of 369.43 g/mol, XLogP of 3.70, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[3-(5-methoxy-3-pyridinyl)pyrazin-2-yl]azetidin-1-yl]quinoline is sourced from PubChem (CID 58547505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).