(2R)-5-[[5-(3-methyl-2H-indazol-5-yl)-3-pyridinyl]oxy]-1-phenylpentan-2-amine

C24H26N4O — CID 23647011

IUPAC(2R)-5-[[5-(3-methyl-2H-indazol-5-yl)-3-pyridinyl]oxy]-1-phenylpentan-2-amine
SMILESCc1[nH]nc2ccc(-c3cncc(OCCC[C@@H](N)Cc4ccccc4)c3)cc12
InChIInChI=1S/C24H26N4O/c1-17-23-14-19(9-10-24(23)28-27-17)20-13-22(16-26-15-20)29-11-5-8-21(25)12-18-6-3-2-4-7-18/h2-4,6-7,9-10,13-16,21H,5,8,11-12,25H2,1H3,(H,27,28)/t21-/m1/s1
InChIKeyLZANKSAKOUCWLW-OAQYLSRUSA-N
MW386.50 g/mol
LogP4.66
Rot. Bonds8

About (2R)-5-[[5-(3-methyl-2H-indazol-5-yl)-3-pyridinyl]oxy]-1-phenylpentan-2-amine

(2R)-5-[[5-(3-methyl-2H-indazol-5-yl)-3-pyridinyl]oxy]-1-phenylpentan-2-amine (PubChem CID 23647011) has the molecular formula C24H26N4O and a molecular weight of 386.50 g/mol. Its IUPAC name is (2R)-5-[[5-(3-methyl-2H-indazol-5-yl)-3-pyridinyl]oxy]-1-phenylpentan-2-amine.

Molecular Properties

Compound Name(2R)-5-[[5-(3-methyl-2H-indazol-5-yl)-3-pyridinyl]oxy]-1-phenylpentan-2-amine
PubChem CID23647011
Molecular FormulaC24H26N4O
Molecular Weight386.50 g/mol
Exact Mass386.21
IUPAC Name(2R)-5-[[5-(3-methyl-2H-indazol-5-yl)-3-pyridinyl]oxy]-1-phenylpentan-2-amine
SMILESCc1[nH]nc2ccc(-c3cncc(OCCC[C@@H](N)Cc4ccccc4)c3)cc12
InChIInChI=1S/C24H26N4O/c1-17-23-14-19(9-10-24(23)28-27-17)20-13-22(16-26-15-20)29-11-5-8-21(25)12-18-6-3-2-4-7-18/h2-4,6-7,9-10,13-16,21H,5,8,11-12,25H2,1H3,(H,27,28)/t21-/m1/s1
InChIKeyLZANKSAKOUCWLW-OAQYLSRUSA-N
XLogP4.66
TPSA76.82 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.50
LogP ≤ 54.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze (2R)-5-[[5-(3-methyl-2H-indazol-5-yl)-3-pyridinyl]oxy]-1-phenylpentan-2-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

A-443654
CID 10172943
Abt-107
CID 11151363
A-674563
CID 11314340
2-((4-(4-pyridin-4-yl-1H-pyrazol-3-yl)phenoxy)methyl)quinoline
CID 11610553
5-{5-[(2S)-2-amino-3-(3-iodophenyl)propoxy]pyridin-3-yl}-3-methyl-1H-indazole
CID 16733025
(2s)-1-{[6-Furan-3-Yl-5-(3-Methyl-2h-Indazol-5-Yl)pyridin-3-Yl]oxy}-3-(1h-Indol-3-Yl)propan-2-Amine
CID 46225540
(1S)-2-(1H-Indol-3-YL)-1-[({5-[(E)-2-pyridin-4-ylvinyl]pyridin-3-YL}oxy)methyl]ethylamine
CID 6914613
3-Pyridin-4-YL-2,4-dihydro-indeno(1,2-.C.) pyrazole
CID 16122642
2-({4-[4-(pyridin-4-ylmethyl)-1H-pyrazol-3-yl]phenoxy}methyl)quinoline
CID 44141871
3-[(2S)-2-amino-3-[3-(trifluoromethyl)phenyl]propoxy]-5-{3-methyl-1H-pyrazolo[3,4-c]pyridin-5-yl}pyridine
CID 11327794
3-[(2S)-2-amino-3-[(5-{1H-pyrazolo[3,4-c]pyridin-5-yl}pyridin-3-yl)oxy]propyl]-1H-indole
CID 16040274
3-[(2S)-2-amino-3-[(5-{3-methyl-1H-pyrazolo[3,4-c]pyridin-5-yl}pyridin-3-yl)oxy]propyl]-1H-indole
CID 23647380

Frequently Asked Questions

What is the IUPAC name of (2R)-5-[[5-(3-methyl-2H-indazol-5-yl)-3-pyridinyl]oxy]-1-phenylpentan-2-amine?
The IUPAC name of (2R)-5-[[5-(3-methyl-2H-indazol-5-yl)-3-pyridinyl]oxy]-1-phenylpentan-2-amine (CID 23647011) is (2R)-5-[[5-(3-methyl-2H-indazol-5-yl)-3-pyridinyl]oxy]-1-phenylpentan-2-amine.
What is the SMILES notation for (2R)-5-[[5-(3-methyl-2H-indazol-5-yl)-3-pyridinyl]oxy]-1-phenylpentan-2-amine?
The canonical SMILES for (2R)-5-[[5-(3-methyl-2H-indazol-5-yl)-3-pyridinyl]oxy]-1-phenylpentan-2-amine is Cc1[nH]nc2ccc(-c3cncc(OCCC[C@@H](N)Cc4ccccc4)c3)cc12.
What is the InChIKey of (2R)-5-[[5-(3-methyl-2H-indazol-5-yl)-3-pyridinyl]oxy]-1-phenylpentan-2-amine?
The InChIKey is LZANKSAKOUCWLW-OAQYLSRUSA-N. The full InChI is InChI=1S/C24H26N4O/c1-17-23-14-19(9-10-24(23)28-27-17)20-13-22(16-26-15-20)29-11-5-8-21(25)12-18-6-3-2-4-7-18/h2-4,6-7,9-10,13-16,21H,5,8,11-12,25H2,1H3,(H,27,28)/t21-/m1/s1.
What are the key properties of (2R)-5-[[5-(3-methyl-2H-indazol-5-yl)-3-pyridinyl]oxy]-1-phenylpentan-2-amine?
(2R)-5-[[5-(3-methyl-2H-indazol-5-yl)-3-pyridinyl]oxy]-1-phenylpentan-2-amine has a molecular weight of 386.50 g/mol, XLogP of 4.66, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-5-[[5-(3-methyl-2H-indazol-5-yl)-3-pyridinyl]oxy]-1-phenylpentan-2-amine is sourced from PubChem (CID 23647011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).