2-[6-(azetidin-1-yl)-3-pyridinyl]-6,7-dimethoxy-4-pyrrolidin-1-ylquinoline

C23H26N4O2 — CID 177174184

IUPAC2-[6-(azetidin-1-yl)-3-pyridinyl]-6,7-dimethoxy-4-pyrrolidin-1-ylquinoline
SMILESCOc1cc2nc(-c3ccc(N4CCC4)nc3)cc(N3CCCC3)c2cc1OC
InChIInChI=1S/C23H26N4O2/c1-28-21-12-17-19(14-22(21)29-2)25-18(13-20(17)26-8-3-4-9-26)16-6-7-23(24-15-16)27-10-5-11-27/h6-7,12-15H,3-5,8-11H2,1-2H3
InChIKeyHHZRULCSSHBAQN-UHFFFAOYSA-N
MW390.49 g/mol
LogP4.12
Rot. Bonds5

About 2-[6-(azetidin-1-yl)-3-pyridinyl]-6,7-dimethoxy-4-pyrrolidin-1-ylquinoline

2-[6-(azetidin-1-yl)-3-pyridinyl]-6,7-dimethoxy-4-pyrrolidin-1-ylquinoline (PubChem CID 177174184) has the molecular formula C23H26N4O2 and a molecular weight of 390.49 g/mol. Its IUPAC name is 2-[6-(azetidin-1-yl)-3-pyridinyl]-6,7-dimethoxy-4-pyrrolidin-1-ylquinoline.

Molecular Properties

Compound Name2-[6-(azetidin-1-yl)-3-pyridinyl]-6,7-dimethoxy-4-pyrrolidin-1-ylquinoline
PubChem CID177174184
Molecular FormulaC23H26N4O2
Molecular Weight390.49 g/mol
Exact Mass390.21
IUPAC Name2-[6-(azetidin-1-yl)-3-pyridinyl]-6,7-dimethoxy-4-pyrrolidin-1-ylquinoline
SMILESCOc1cc2nc(-c3ccc(N4CCC4)nc3)cc(N3CCCC3)c2cc1OC
InChIInChI=1S/C23H26N4O2/c1-28-21-12-17-19(14-22(21)29-2)25-18(13-20(17)26-8-3-4-9-26)16-6-7-23(24-15-16)27-10-5-11-27/h6-7,12-15H,3-5,8-11H2,1-2H3
InChIKeyHHZRULCSSHBAQN-UHFFFAOYSA-N
XLogP4.12
TPSA50.72 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.49
LogP ≤ 54.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2-[6-(azetidin-1-yl)-3-pyridinyl]-6,7-dimethoxy-4-pyrrolidin-1-ylquinoline 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

2-[6-(azetidin-1-yl)-3-pyridinyl]-4-chloro-6-fluoro-7-methoxyquinoline
CID 177172502
4-chloro-6-fluoro-7-methoxy-2-(6-pyrrolidin-1-yl-3-pyridinyl)quinoline
CID 177174040
[1-[2-[6-(azetidin-1-yl)-3-pyridinyl]-6-fluoro-7-methoxyquinolin-4-yl]pyrrolidin-3-yl]methanol
CID 177174104
7-[2-[6-(azetidin-1-yl)-3-pyridinyl]-6-fluoro-7-methoxyquinolin-4-yl]-3-methyl-2λ6-thia-3,7-diazaspiro[4.4]nonane 2,2-dioxide
CID 177173104
2-(4-methoxyphenyl)-4-pyrrolidin-1-ylquinoline
CID 45051409
1,4-bis[5-(3,5-dimethoxy-4-propan-2-yloxyphenyl)-2-pyridinyl]-1,4-diazepane;methanesulfonic acid
CID 20634982
5-(3-methoxy-4-pyrrolidin-1-ylphenyl)-1,7-dimethylpyrazolo[4,5-b]pyridine
CID 170506179
4-(3-methoxypyrrolidin-1-yl)-N,N-dimethyl-2-(6-piperazin-1-yl-3-pyridinyl)quinolin-7-amine
CID 177174244
tert-butyl 4-[5-[4-[3-(hydroxymethyl)pyrrolidin-1-yl]-7-methoxyquinolin-2-yl]-2-pyridinyl]piperazine-1-carboxylate
CID 177173250
7-(6-morpholin-4-yl-3-pyridinyl)-5-pyrrolidin-1-ylpyrido[2,3-d]pyrimidin-4-amine
CID 11014315
1,4-bis[5-(3,4-dimethoxy-5-phenylmethoxyphenyl)-2-pyridinyl]-1,4-diazepane
CID 20634961
6,7-dimethoxy-2-(4-methylphenyl)quinoline-4-carboxylic acid
CID 18073657

Frequently Asked Questions

What is the IUPAC name of 2-[6-(azetidin-1-yl)-3-pyridinyl]-6,7-dimethoxy-4-pyrrolidin-1-ylquinoline?
The IUPAC name of 2-[6-(azetidin-1-yl)-3-pyridinyl]-6,7-dimethoxy-4-pyrrolidin-1-ylquinoline (CID 177174184) is 2-[6-(azetidin-1-yl)-3-pyridinyl]-6,7-dimethoxy-4-pyrrolidin-1-ylquinoline.
What is the SMILES notation for 2-[6-(azetidin-1-yl)-3-pyridinyl]-6,7-dimethoxy-4-pyrrolidin-1-ylquinoline?
The canonical SMILES for 2-[6-(azetidin-1-yl)-3-pyridinyl]-6,7-dimethoxy-4-pyrrolidin-1-ylquinoline is COc1cc2nc(-c3ccc(N4CCC4)nc3)cc(N3CCCC3)c2cc1OC.
What is the InChIKey of 2-[6-(azetidin-1-yl)-3-pyridinyl]-6,7-dimethoxy-4-pyrrolidin-1-ylquinoline?
The InChIKey is HHZRULCSSHBAQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N4O2/c1-28-21-12-17-19(14-22(21)29-2)25-18(13-20(17)26-8-3-4-9-26)16-6-7-23(24-15-16)27-10-5-11-27/h6-7,12-15H,3-5,8-11H2,1-2H3.
What are the key properties of 2-[6-(azetidin-1-yl)-3-pyridinyl]-6,7-dimethoxy-4-pyrrolidin-1-ylquinoline?
2-[6-(azetidin-1-yl)-3-pyridinyl]-6,7-dimethoxy-4-pyrrolidin-1-ylquinoline has a molecular weight of 390.49 g/mol, XLogP of 4.12, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-(azetidin-1-yl)-3-pyridinyl]-6,7-dimethoxy-4-pyrrolidin-1-ylquinoline is sourced from PubChem (CID 177174184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).