N-[4-(2-methylindol-1-yl)phenyl]-2-pyridin-3-ylacetamide

C22H19N3O — CID 139981145

IUPACN-[4-(2-methylindol-1-yl)phenyl]-2-pyridin-3-ylacetamide
SMILESCc1cc2ccccc2n1-c1ccc(NC(=O)Cc2cccnc2)cc1
InChIInChI=1S/C22H19N3O/c1-16-13-18-6-2-3-7-21(18)25(16)20-10-8-19(9-11-20)24-22(26)14-17-5-4-12-23-15-17/h2-13,15H,14H2,1H3,(H,24,26)
InChIKeyQBHIACYLXCGFBN-UHFFFAOYSA-N
MW341.41 g/mol
LogP4.52
Rot. Bonds4

About N-[4-(2-methylindol-1-yl)phenyl]-2-pyridin-3-ylacetamide

N-[4-(2-methylindol-1-yl)phenyl]-2-pyridin-3-ylacetamide (PubChem CID 139981145) has the molecular formula C22H19N3O and a molecular weight of 341.41 g/mol. Its IUPAC name is N-[4-(2-methylindol-1-yl)phenyl]-2-pyridin-3-ylacetamide.

Molecular Properties

Compound NameN-[4-(2-methylindol-1-yl)phenyl]-2-pyridin-3-ylacetamide
PubChem CID139981145
Molecular FormulaC22H19N3O
Molecular Weight341.41 g/mol
Exact Mass341.15
IUPAC NameN-[4-(2-methylindol-1-yl)phenyl]-2-pyridin-3-ylacetamide
SMILESCc1cc2ccccc2n1-c1ccc(NC(=O)Cc2cccnc2)cc1
InChIInChI=1S/C22H19N3O/c1-16-13-18-6-2-3-7-21(18)25(16)20-10-8-19(9-11-20)24-22(26)14-17-5-4-12-23-15-17/h2-13,15H,14H2,1H3,(H,24,26)
InChIKeyQBHIACYLXCGFBN-UHFFFAOYSA-N
XLogP4.52
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 54.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(5-cyano-2-methylindol-1-yl)phenyl]-2-pyridin-3-ylacetamide
CID 139981144
N-[4-[5-(furan-2-yl)-2-methylsulfanylindol-1-yl]phenyl]-2-pyridin-3-ylacetamide
CID 139981131
N-[4-(5-cyclopropyl-3-methylpyrazol-1-yl)phenyl]-2-pyridin-3-ylacetamide;hydrochloride
CID 123743286
3-oxo-N-phenyl-4-pyridin-3-ylbutanamide
CID 131865555
N-[4-[2-methylsulfanyl-4-(oxolan-3-yl)indol-1-yl]phenyl]-2-pyridin-3-ylacetamide
CID 139981168
2-pyridin-3-yl-N-(2,4,6-trimethylphenyl)acetamide
CID 110697139
N-[4-[(2-pyridin-3-ylacetyl)amino]phenyl]furan-2-carboxamide
CID 17297144
N-cyclopropyl-2-[4-[(2-pyridin-3-ylacetyl)amino]phenyl]acetamide
CID 131905029
2-[5-[(2-pyridin-3-ylacetyl)amino]-2-pyridinyl]acetic acid
CID 107339387
N-[4-(6-methyl-1H-benzimidazol-2-yl)phenyl]-2-pyridin-3-ylacetamide
CID 146021518
3-[3-[(2-pyridin-3-ylacetyl)amino]phenyl]propanoic acid
CID 115339339
N-(4-methyl-2-phenyl-1,3-thiazol-5-yl)-2-pyridin-3-ylacetamide
CID 75503297

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-methylindol-1-yl)phenyl]-2-pyridin-3-ylacetamide?
The IUPAC name of N-[4-(2-methylindol-1-yl)phenyl]-2-pyridin-3-ylacetamide (CID 139981145) is N-[4-(2-methylindol-1-yl)phenyl]-2-pyridin-3-ylacetamide.
What is the SMILES notation for N-[4-(2-methylindol-1-yl)phenyl]-2-pyridin-3-ylacetamide?
The canonical SMILES for N-[4-(2-methylindol-1-yl)phenyl]-2-pyridin-3-ylacetamide is Cc1cc2ccccc2n1-c1ccc(NC(=O)Cc2cccnc2)cc1.
What is the InChIKey of N-[4-(2-methylindol-1-yl)phenyl]-2-pyridin-3-ylacetamide?
The InChIKey is QBHIACYLXCGFBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N3O/c1-16-13-18-6-2-3-7-21(18)25(16)20-10-8-19(9-11-20)24-22(26)14-17-5-4-12-23-15-17/h2-13,15H,14H2,1H3,(H,24,26).
What are the key properties of N-[4-(2-methylindol-1-yl)phenyl]-2-pyridin-3-ylacetamide?
N-[4-(2-methylindol-1-yl)phenyl]-2-pyridin-3-ylacetamide has a molecular weight of 341.41 g/mol, XLogP of 4.52, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-methylindol-1-yl)phenyl]-2-pyridin-3-ylacetamide is sourced from PubChem (CID 139981145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).