5-(6,7-dichloro-1H-imidazo[4,5-b]pyridin-2-yl)-2-morpholin-4-ylaniline

C16H15Cl2N5O — CID 69373889

IUPAC5-(6,7-dichloro-1H-imidazo[4,5-b]pyridin-2-yl)-2-morpholin-4-ylaniline
SMILESNc1cc(-c2nc3ncc(Cl)c(Cl)c3[nH]2)ccc1N1CCOCC1
InChIInChI=1S/C16H15Cl2N5O/c17-10-8-20-16-14(13(10)18)21-15(22-16)9-1-2-12(11(19)7-9)23-3-5-24-6-4-23/h1-2,7-8H,3-6,19H2,(H,20,21,22)
InChIKeyZHBFEUWVZJNGIP-UHFFFAOYSA-N
MW364.24 g/mol
LogP3.35
Rot. Bonds2

About 5-(6,7-dichloro-1H-imidazo[4,5-b]pyridin-2-yl)-2-morpholin-4-ylaniline

5-(6,7-dichloro-1H-imidazo[4,5-b]pyridin-2-yl)-2-morpholin-4-ylaniline (PubChem CID 69373889) has the molecular formula C16H15Cl2N5O and a molecular weight of 364.24 g/mol. Its IUPAC name is 5-(6,7-dichloro-1H-imidazo[4,5-b]pyridin-2-yl)-2-morpholin-4-ylaniline.

Molecular Properties

Compound Name5-(6,7-dichloro-1H-imidazo[4,5-b]pyridin-2-yl)-2-morpholin-4-ylaniline
PubChem CID69373889
Molecular FormulaC16H15Cl2N5O
Molecular Weight364.24 g/mol
Exact Mass363.07
IUPAC Name5-(6,7-dichloro-1H-imidazo[4,5-b]pyridin-2-yl)-2-morpholin-4-ylaniline
SMILESNc1cc(-c2nc3ncc(Cl)c(Cl)c3[nH]2)ccc1N1CCOCC1
InChIInChI=1S/C16H15Cl2N5O/c17-10-8-20-16-14(13(10)18)21-15(22-16)9-1-2-12(11(19)7-9)23-3-5-24-6-4-23/h1-2,7-8H,3-6,19H2,(H,20,21,22)
InChIKeyZHBFEUWVZJNGIP-UHFFFAOYSA-N
XLogP3.35
TPSA80.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.24
LogP ≤ 53.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

5-(6,7-dichloro-1H-imidazo[4,5-b]pyridin-2-yl)-2-morpholin-4-ylaniline;4-[4-(6,7-dichloro-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]morpholine
CID 161336451
5-(6-chloro-7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)-2-(4-methylpiperazin-1-yl)aniline
CID 69213443
(1S,2S,3R,4S)-3-[[6-bromo-2-(3-chloro-4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridin-7-yl]amino]bicyclo[2.2.1]hept-5-ene-2-carboxamide
CID 71679171
[4-(6-chloro-7-iodo-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]-morpholin-4-ylmethanone
CID 25028462
3-(3-amino-4-morpholin-4-ylphenyl)-1H-pyridazin-6-one
CID 25249937
5-chloro-2-(1,4-oxazepan-4-yl)aniline
CID 62987959
3-(3-chloro-4-morpholin-4-ylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-amine
CID 70974901
5-methyl-2-morpholin-4-ylaniline
CID 18952141
[(1R,2R,3S,4S)-3-[[6-chloro-2-(3-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridin-7-yl]amino]-2-bicyclo[2.2.1]hept-5-enyl] carbamate
CID 118643728
2-morpholin-4-yl-5-(2-propan-2-yl-1,3-thiazol-4-yl)aniline
CID 82105878
2-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridine-7-carboxylic acid
CID 140538831
2-chloro-5-(6-methyl-1H-imidazo[4,5-b]pyridin-2-yl)aniline
CID 79795619

Frequently Asked Questions

What is the IUPAC name of 5-(6,7-dichloro-1H-imidazo[4,5-b]pyridin-2-yl)-2-morpholin-4-ylaniline?
The IUPAC name of 5-(6,7-dichloro-1H-imidazo[4,5-b]pyridin-2-yl)-2-morpholin-4-ylaniline (CID 69373889) is 5-(6,7-dichloro-1H-imidazo[4,5-b]pyridin-2-yl)-2-morpholin-4-ylaniline.
What is the SMILES notation for 5-(6,7-dichloro-1H-imidazo[4,5-b]pyridin-2-yl)-2-morpholin-4-ylaniline?
The canonical SMILES for 5-(6,7-dichloro-1H-imidazo[4,5-b]pyridin-2-yl)-2-morpholin-4-ylaniline is Nc1cc(-c2nc3ncc(Cl)c(Cl)c3[nH]2)ccc1N1CCOCC1.
What is the InChIKey of 5-(6,7-dichloro-1H-imidazo[4,5-b]pyridin-2-yl)-2-morpholin-4-ylaniline?
The InChIKey is ZHBFEUWVZJNGIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15Cl2N5O/c17-10-8-20-16-14(13(10)18)21-15(22-16)9-1-2-12(11(19)7-9)23-3-5-24-6-4-23/h1-2,7-8H,3-6,19H2,(H,20,21,22).
What are the key properties of 5-(6,7-dichloro-1H-imidazo[4,5-b]pyridin-2-yl)-2-morpholin-4-ylaniline?
5-(6,7-dichloro-1H-imidazo[4,5-b]pyridin-2-yl)-2-morpholin-4-ylaniline has a molecular weight of 364.24 g/mol, XLogP of 3.35, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(6,7-dichloro-1H-imidazo[4,5-b]pyridin-2-yl)-2-morpholin-4-ylaniline is sourced from PubChem (CID 69373889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).