N-(1H-indazol-6-yl)-2-phenyl-3-pyridin-3-ylpropanamide

C21H18N4O — CID 110673734

IUPACN-(1H-indazol-6-yl)-2-phenyl-3-pyridin-3-ylpropanamide
SMILESO=C(Nc1ccc2cn[nH]c2c1)C(Cc1cccnc1)c1ccccc1
InChIInChI=1S/C21H18N4O/c26-21(24-18-9-8-17-14-23-25-20(17)12-18)19(16-6-2-1-3-7-16)11-15-5-4-10-22-13-15/h1-10,12-14,19H,11H2,(H,23,25)(H,24,26)
InChIKeyRAKSRXNWPMNBBE-UHFFFAOYSA-N
MW342.40 g/mol
LogP3.92
Rot. Bonds5

About N-(1H-indazol-6-yl)-2-phenyl-3-pyridin-3-ylpropanamide

N-(1H-indazol-6-yl)-2-phenyl-3-pyridin-3-ylpropanamide (PubChem CID 110673734) has the molecular formula C21H18N4O and a molecular weight of 342.40 g/mol. Its IUPAC name is N-(1H-indazol-6-yl)-2-phenyl-3-pyridin-3-ylpropanamide.

Molecular Properties

Compound NameN-(1H-indazol-6-yl)-2-phenyl-3-pyridin-3-ylpropanamide
PubChem CID110673734
Molecular FormulaC21H18N4O
Molecular Weight342.40 g/mol
Exact Mass342.15
IUPAC NameN-(1H-indazol-6-yl)-2-phenyl-3-pyridin-3-ylpropanamide
SMILESO=C(Nc1ccc2cn[nH]c2c1)C(Cc1cccnc1)c1ccccc1
InChIInChI=1S/C21H18N4O/c26-21(24-18-9-8-17-14-23-25-20(17)12-18)19(16-6-2-1-3-7-16)11-15-5-4-10-22-13-15/h1-10,12-14,19H,11H2,(H,23,25)(H,24,26)
InChIKeyRAKSRXNWPMNBBE-UHFFFAOYSA-N
XLogP3.92
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.40
LogP ≤ 53.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-fluorophenyl)-2-phenyl-3-pyridin-3-ylpropanamide
CID 110425726
N-[4-(cyclopropanecarbonyl)phenyl]-2-phenyl-3-pyridin-3-ylpropanamide
CID 110425839
2-phenyl-3-pyridin-3-ylpropanamide
CID 171502842
N-(4-acetamidophenyl)-2-(4-chlorophenyl)-3-pyridin-3-ylpropanamide
CID 110296801
1-(1H-indazol-6-yl)-3-(2-phenylethyl)urea
CID 71655790
2-chloro-N-(1H-indazol-5-yl)-2-phenylacetamide
CID 43698093
N-[(4-fluorophenyl)methyl]-2-phenyl-3-pyridin-3-ylpropanamide
CID 110409718
2-[5-(3-chloro-2,6-difluorophenyl)-2-pyridinyl]-N-(1H-indazol-6-yl)-3-phenylpropanamide
CID 130210411
N-(2,5-dimethoxyphenyl)-2-phenyl-3-pyridin-3-ylpropanamide
CID 110422839
N-ethyl-N'-(1H-indazol-6-yl)oxamide
CID 108521463
N-[(4-methylphenyl)methyl]-2-phenyl-3-pyridin-3-ylpropanamide
CID 110409246
N-(1H-indazol-6-yl)-2-(3-methoxyphenyl)acetamide
CID 36561093

Frequently Asked Questions

What is the IUPAC name of N-(1H-indazol-6-yl)-2-phenyl-3-pyridin-3-ylpropanamide?
The IUPAC name of N-(1H-indazol-6-yl)-2-phenyl-3-pyridin-3-ylpropanamide (CID 110673734) is N-(1H-indazol-6-yl)-2-phenyl-3-pyridin-3-ylpropanamide.
What is the SMILES notation for N-(1H-indazol-6-yl)-2-phenyl-3-pyridin-3-ylpropanamide?
The canonical SMILES for N-(1H-indazol-6-yl)-2-phenyl-3-pyridin-3-ylpropanamide is O=C(Nc1ccc2cn[nH]c2c1)C(Cc1cccnc1)c1ccccc1.
What is the InChIKey of N-(1H-indazol-6-yl)-2-phenyl-3-pyridin-3-ylpropanamide?
The InChIKey is RAKSRXNWPMNBBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N4O/c26-21(24-18-9-8-17-14-23-25-20(17)12-18)19(16-6-2-1-3-7-16)11-15-5-4-10-22-13-15/h1-10,12-14,19H,11H2,(H,23,25)(H,24,26).
What are the key properties of N-(1H-indazol-6-yl)-2-phenyl-3-pyridin-3-ylpropanamide?
N-(1H-indazol-6-yl)-2-phenyl-3-pyridin-3-ylpropanamide has a molecular weight of 342.40 g/mol, XLogP of 3.92, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indazol-6-yl)-2-phenyl-3-pyridin-3-ylpropanamide is sourced from PubChem (CID 110673734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).