5-(1H-indazol-6-yl)-N-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridin-7-amine

C23H21N7O — CID 162666718

IUPAC5-(1H-indazol-6-yl)-N-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridin-7-amine
SMILESc1nc2nc(-c3ccc4cn[nH]c4c3)cc(Nc3ccc(N4CCOCC4)cc3)c2[nH]1
InChIInChI=1S/C23H21N7O/c1-2-16-13-26-29-20(16)11-15(1)19-12-21(22-23(28-19)25-14-24-22)27-17-3-5-18(6-4-17)30-7-9-31-10-8-30/h1-6,11-14H,7-10H2,(H,26,29)(H2,24,25,27,28)
InChIKeyMCZRDSMWHJDZIV-UHFFFAOYSA-N
MW411.47 g/mol
LogP4.08
Rot. Bonds4

About 5-(1H-indazol-6-yl)-N-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridin-7-amine

5-(1H-indazol-6-yl)-N-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridin-7-amine (PubChem CID 162666718) has the molecular formula C23H21N7O and a molecular weight of 411.47 g/mol. Its IUPAC name is 5-(1H-indazol-6-yl)-N-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridin-7-amine.

Molecular Properties

Compound Name5-(1H-indazol-6-yl)-N-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridin-7-amine
PubChem CID162666718
Molecular FormulaC23H21N7O
Molecular Weight411.47 g/mol
Exact Mass411.18
IUPAC Name5-(1H-indazol-6-yl)-N-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridin-7-amine
SMILESc1nc2nc(-c3ccc4cn[nH]c4c3)cc(Nc3ccc(N4CCOCC4)cc3)c2[nH]1
InChIInChI=1S/C23H21N7O/c1-2-16-13-26-29-20(16)11-15(1)19-12-21(22-23(28-19)25-14-24-22)27-17-3-5-18(6-4-17)30-7-9-31-10-8-30/h1-6,11-14H,7-10H2,(H,26,29)(H2,24,25,27,28)
InChIKeyMCZRDSMWHJDZIV-UHFFFAOYSA-N
XLogP4.08
TPSA94.75 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500411.47
LogP ≤ 54.08
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

Analyze 5-(1H-indazol-6-yl)-N-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridin-7-amine 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

At-9283
CID 135398495
Bms-599626
CID 10437018
Entospletinib
CID 59473233
N6,N6-dimethyl-N4-[1-(phenylmethyl)-5-indazolyl]pyrido[3,4-d]pyrimidine-4,6-diamine
CID 6603857
Bms-986299
CID 137498152
8-(1H-indol-4-yl)-2,6-bis((3R)-3-methylmorpholin-4-yl)-7H-purine
CID 60148794
8-(1H-indol-4-yl)-6-[(3R)-3-methylmorpholin-4-yl]-2-[(3S)-3-methylmorpholin-4-yl]-9H-purine
CID 60148924
(3~{R},4~{R})-~{N}4-[1-[2-(1-methylindol-4-yl)-3~{H}-imidazo[4,5-b]pyridin-7-yl]pyrazol-4-yl]oxane-3,4-diamine
CID 155925935
N-(1H-indazol-5-yl)-N'-[2-(1H-indol-3-yl)ethyl]-6-methoxy-1,3,5-triazine-2,4-diamine
CID 10111591
3-(2-benzyl-1H-benzo[d]imidazol-6-yl)-1-((trans)-4-morpholinocyclohexyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
CID 25218685
4-(6-(1H-Indol-5-yl)-1-(1-(pyridin-3-ylmethyl)piperidin-4-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl)morpholine
CID 25229526
6-(1H-indol-5-yl)-4-morpholin-4-yl-1-piperidin-4-yl-1H-pyrazolo[3,4-d]pyrimidine
CID 44520824

Frequently Asked Questions

What is the IUPAC name of 5-(1H-indazol-6-yl)-N-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridin-7-amine?
The IUPAC name of 5-(1H-indazol-6-yl)-N-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridin-7-amine (CID 162666718) is 5-(1H-indazol-6-yl)-N-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridin-7-amine.
What is the SMILES notation for 5-(1H-indazol-6-yl)-N-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridin-7-amine?
The canonical SMILES for 5-(1H-indazol-6-yl)-N-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridin-7-amine is c1nc2nc(-c3ccc4cn[nH]c4c3)cc(Nc3ccc(N4CCOCC4)cc3)c2[nH]1.
What is the InChIKey of 5-(1H-indazol-6-yl)-N-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridin-7-amine?
The InChIKey is MCZRDSMWHJDZIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N7O/c1-2-16-13-26-29-20(16)11-15(1)19-12-21(22-23(28-19)25-14-24-22)27-17-3-5-18(6-4-17)30-7-9-31-10-8-30/h1-6,11-14H,7-10H2,(H,26,29)(H2,24,25,27,28).
What are the key properties of 5-(1H-indazol-6-yl)-N-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridin-7-amine?
5-(1H-indazol-6-yl)-N-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridin-7-amine has a molecular weight of 411.47 g/mol, XLogP of 4.08, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1H-indazol-6-yl)-N-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridin-7-amine is sourced from PubChem (CID 162666718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).