N-[3-[[2-(1H-indol-3-yl)acetyl]amino]phenyl]pyridine-3-carboxamide

C22H18N4O2 — CID 46400273

IUPACN-[3-[[2-(1H-indol-3-yl)acetyl]amino]phenyl]pyridine-3-carboxamide
SMILESO=C(Cc1c[nH]c2ccccc12)Nc1cccc(NC(=O)c2cccnc2)c1
InChIInChI=1S/C22H18N4O2/c27-21(11-16-14-24-20-9-2-1-8-19(16)20)25-17-6-3-7-18(12-17)26-22(28)15-5-4-10-23-13-15/h1-10,12-14,24H,11H2,(H,25,27)(H,26,28)
InChIKeyXBBSXXCNUHJZEX-UHFFFAOYSA-N
MW370.41 g/mol
LogP4.00
Rot. Bonds5

About N-[3-[[2-(1H-indol-3-yl)acetyl]amino]phenyl]pyridine-3-carboxamide

N-[3-[[2-(1H-indol-3-yl)acetyl]amino]phenyl]pyridine-3-carboxamide (PubChem CID 46400273) has the molecular formula C22H18N4O2 and a molecular weight of 370.41 g/mol. Its IUPAC name is N-[3-[[2-(1H-indol-3-yl)acetyl]amino]phenyl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[3-[[2-(1H-indol-3-yl)acetyl]amino]phenyl]pyridine-3-carboxamide
PubChem CID46400273
Molecular FormulaC22H18N4O2
Molecular Weight370.41 g/mol
Exact Mass370.14
IUPAC NameN-[3-[[2-(1H-indol-3-yl)acetyl]amino]phenyl]pyridine-3-carboxamide
SMILESO=C(Cc1c[nH]c2ccccc12)Nc1cccc(NC(=O)c2cccnc2)c1
InChIInChI=1S/C22H18N4O2/c27-21(11-16-14-24-20-9-2-1-8-19(16)20)25-17-6-3-7-18(12-17)26-22(28)15-5-4-10-23-13-15/h1-10,12-14,24H,11H2,(H,25,27)(H,26,28)
InChIKeyXBBSXXCNUHJZEX-UHFFFAOYSA-N
XLogP4.00
TPSA86.88 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.41
LogP ≤ 54.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-[[(2-phenylacetyl)amino]methyl]phenyl]pyridine-3-carboxamide
CID 108926276
N-[3-[[2-(2-chlorophenyl)acetyl]amino]phenyl]pyridine-3-carboxamide
CID 108925213
2-(1H-indol-3-yl)-N-[3-(methylcarbamoylamino)phenyl]acetamide
CID 38160633
N-[3-[[2-(2-nitrophenyl)acetyl]amino]phenyl]pyridine-3-carboxamide
CID 39678604
N-[3-[2-(1H-indol-3-yl)ethyl]-4-oxoquinazolin-6-yl]pyridine-3-carboxamide
CID 176910347
N-[3-[[2-(3-methylphenyl)acetyl]amino]phenyl]pyridine-3-carboxamide
CID 108925215
N-[(2S)-1-anilino-3-(1H-indol-3-yl)-1-oxopropan-2-yl]pyridine-3-carboxamide
CID 110286567
N-[3-[(2-cyanoacetyl)amino]phenyl]pyridine-3-carboxamide
CID 108922649
N-(3,4-dihydroxyphenyl)-2-(1H-indol-3-yl)acetamide
CID 170716792
2-(1H-indol-3-yl)-N-(3-methyl-4-pyridinyl)acetamide
CID 63671729
N-[4-[[(2-phenylacetyl)amino]methyl]phenyl]pyridine-3-carboxamide
CID 108925504
N-[3-[[2-(6-methyl-1-benzofuran-3-yl)acetyl]amino]phenyl]pyridine-3-carboxamide
CID 39678884

Frequently Asked Questions

What is the IUPAC name of N-[3-[[2-(1H-indol-3-yl)acetyl]amino]phenyl]pyridine-3-carboxamide?
The IUPAC name of N-[3-[[2-(1H-indol-3-yl)acetyl]amino]phenyl]pyridine-3-carboxamide (CID 46400273) is N-[3-[[2-(1H-indol-3-yl)acetyl]amino]phenyl]pyridine-3-carboxamide.
What is the SMILES notation for N-[3-[[2-(1H-indol-3-yl)acetyl]amino]phenyl]pyridine-3-carboxamide?
The canonical SMILES for N-[3-[[2-(1H-indol-3-yl)acetyl]amino]phenyl]pyridine-3-carboxamide is O=C(Cc1c[nH]c2ccccc12)Nc1cccc(NC(=O)c2cccnc2)c1.
What is the InChIKey of N-[3-[[2-(1H-indol-3-yl)acetyl]amino]phenyl]pyridine-3-carboxamide?
The InChIKey is XBBSXXCNUHJZEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N4O2/c27-21(11-16-14-24-20-9-2-1-8-19(16)20)25-17-6-3-7-18(12-17)26-22(28)15-5-4-10-23-13-15/h1-10,12-14,24H,11H2,(H,25,27)(H,26,28).
What are the key properties of N-[3-[[2-(1H-indol-3-yl)acetyl]amino]phenyl]pyridine-3-carboxamide?
N-[3-[[2-(1H-indol-3-yl)acetyl]amino]phenyl]pyridine-3-carboxamide has a molecular weight of 370.41 g/mol, XLogP of 4.00, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[[2-(1H-indol-3-yl)acetyl]amino]phenyl]pyridine-3-carboxamide is sourced from PubChem (CID 46400273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).