3,5-dichloro-N-methyl-N-[phenyl(pyridin-2-yl)methyl]-1H-indole-2-carboxamide

C22H17Cl2N3O — CID 55967482

IUPAC3,5-dichloro-N-methyl-N-[phenyl(pyridin-2-yl)methyl]-1H-indole-2-carboxamide
SMILESCN(C(=O)c1[nH]c2ccc(Cl)cc2c1Cl)C(c1ccccc1)c1ccccn1
InChIInChI=1S/C22H17Cl2N3O/c1-27(21(14-7-3-2-4-8-14)18-9-5-6-12-25-18)22(28)20-19(24)16-13-15(23)10-11-17(16)26-20/h2-13,21,26H,1H3
InChIKeyXDKUYYPYHPXEJL-UHFFFAOYSA-N
MW410.30 g/mol
LogP5.73
Rot. Bonds4

About 3,5-dichloro-N-methyl-N-[phenyl(pyridin-2-yl)methyl]-1H-indole-2-carboxamide

3,5-dichloro-N-methyl-N-[phenyl(pyridin-2-yl)methyl]-1H-indole-2-carboxamide (PubChem CID 55967482) has the molecular formula C22H17Cl2N3O and a molecular weight of 410.30 g/mol. Its IUPAC name is 3,5-dichloro-N-methyl-N-[phenyl(pyridin-2-yl)methyl]-1H-indole-2-carboxamide.

Molecular Properties

Compound Name3,5-dichloro-N-methyl-N-[phenyl(pyridin-2-yl)methyl]-1H-indole-2-carboxamide
PubChem CID55967482
Molecular FormulaC22H17Cl2N3O
Molecular Weight410.30 g/mol
Exact Mass409.07
IUPAC Name3,5-dichloro-N-methyl-N-[phenyl(pyridin-2-yl)methyl]-1H-indole-2-carboxamide
SMILESCN(C(=O)c1[nH]c2ccc(Cl)cc2c1Cl)C(c1ccccc1)c1ccccn1
InChIInChI=1S/C22H17Cl2N3O/c1-27(21(14-7-3-2-4-8-14)18-9-5-6-12-25-18)22(28)20-19(24)16-13-15(23)10-11-17(16)26-20/h2-13,21,26H,1H3
InChIKeyXDKUYYPYHPXEJL-UHFFFAOYSA-N
XLogP5.73
TPSA48.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500410.30
LogP ≤ 55.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3,5-dichloro-N-methyl-N-[phenyl(pyridin-2-yl)methyl]-1H-indole-2-carboxamide 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

3,5-dichloro-N-[2-(dimethylamino)-2-phenylethyl]-1H-indole-2-carboxamide
CID 55644479
N-methyl-2-oxo-N-[(S)-phenyl(pyridin-2-yl)methyl]-1H-pyridine-3-carboxamide
CID 94822267
4-(4-chloro-2-methylphenoxy)-N-methyl-N-[phenyl(pyridin-2-yl)methyl]butanamide
CID 55768262
3,5-dichloro-N-(2-methoxy-2-phenylethyl)-1H-indole-2-carboxamide
CID 60543987
5-chloro-N-(1-hydroxypropan-2-yl)-N-methyl-3-phenyl-1H-indole-2-carboxamide
CID 56882195
N,2-dimethyl-6-phenyl-N-[phenyl(pyridin-2-yl)methyl]pyridine-3-carboxamide
CID 55767309
3-methoxy-N-methyl-N-[phenyl(pyridin-2-yl)methyl]-4-propan-2-yloxybenzamide
CID 55767493
3,5-dichloro-N-(2-hydroxypropyl)-1H-indole-2-carboxamide
CID 110900787
3-[(3,5-dichloro-1H-indole-2-carbonyl)-ethylamino]propanoic acid
CID 119191758
3,5-dichloro-N-[(4-fluorophenyl)methyl]-N-methyl-1H-indole-2-carboxamide
CID 55913427
3,4,5-trimethoxy-N-methyl-2-nitro-N-[phenyl(pyridin-2-yl)methyl]benzamide
CID 55881341
N-[(1R)-2-methoxy-1-pyridin-2-ylethyl]-N,3,5-trimethyl-1H-indole-2-carboxamide
CID 97132449

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-N-methyl-N-[phenyl(pyridin-2-yl)methyl]-1H-indole-2-carboxamide?
The IUPAC name of 3,5-dichloro-N-methyl-N-[phenyl(pyridin-2-yl)methyl]-1H-indole-2-carboxamide (CID 55967482) is 3,5-dichloro-N-methyl-N-[phenyl(pyridin-2-yl)methyl]-1H-indole-2-carboxamide.
What is the SMILES notation for 3,5-dichloro-N-methyl-N-[phenyl(pyridin-2-yl)methyl]-1H-indole-2-carboxamide?
The canonical SMILES for 3,5-dichloro-N-methyl-N-[phenyl(pyridin-2-yl)methyl]-1H-indole-2-carboxamide is CN(C(=O)c1[nH]c2ccc(Cl)cc2c1Cl)C(c1ccccc1)c1ccccn1.
What is the InChIKey of 3,5-dichloro-N-methyl-N-[phenyl(pyridin-2-yl)methyl]-1H-indole-2-carboxamide?
The InChIKey is XDKUYYPYHPXEJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17Cl2N3O/c1-27(21(14-7-3-2-4-8-14)18-9-5-6-12-25-18)22(28)20-19(24)16-13-15(23)10-11-17(16)26-20/h2-13,21,26H,1H3.
What are the key properties of 3,5-dichloro-N-methyl-N-[phenyl(pyridin-2-yl)methyl]-1H-indole-2-carboxamide?
3,5-dichloro-N-methyl-N-[phenyl(pyridin-2-yl)methyl]-1H-indole-2-carboxamide has a molecular weight of 410.30 g/mol, XLogP of 5.73, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-N-methyl-N-[phenyl(pyridin-2-yl)methyl]-1H-indole-2-carboxamide is sourced from PubChem (CID 55967482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).