N-[2-(1H-indol-3-yl)ethyl]-2-piperidin-1-ylpyridine-3-carboxamide

C21H24N4O — CID 84576774

IUPACN-[2-(1H-indol-3-yl)ethyl]-2-piperidin-1-ylpyridine-3-carboxamide
SMILESO=C(NCCc1c[nH]c2ccccc12)c1cccnc1N1CCCCC1
InChIInChI=1S/C21H24N4O/c26-21(18-8-6-11-22-20(18)25-13-4-1-5-14-25)23-12-10-16-15-24-19-9-3-2-7-17(16)19/h2-3,6-9,11,15,24H,1,4-5,10,12-14H2,(H,23,26)
InChIKeyMIGWUZDVBMOKNE-UHFFFAOYSA-N
MW348.45 g/mol
LogP3.53
Rot. Bonds5

About N-[2-(1H-indol-3-yl)ethyl]-2-piperidin-1-ylpyridine-3-carboxamide

N-[2-(1H-indol-3-yl)ethyl]-2-piperidin-1-ylpyridine-3-carboxamide (PubChem CID 84576774) has the molecular formula C21H24N4O and a molecular weight of 348.45 g/mol. Its IUPAC name is N-[2-(1H-indol-3-yl)ethyl]-2-piperidin-1-ylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-[2-(1H-indol-3-yl)ethyl]-2-piperidin-1-ylpyridine-3-carboxamide
PubChem CID84576774
Molecular FormulaC21H24N4O
Molecular Weight348.45 g/mol
Exact Mass348.20
IUPAC NameN-[2-(1H-indol-3-yl)ethyl]-2-piperidin-1-ylpyridine-3-carboxamide
SMILESO=C(NCCc1c[nH]c2ccccc12)c1cccnc1N1CCCCC1
InChIInChI=1S/C21H24N4O/c26-21(18-8-6-11-22-20(18)25-13-4-1-5-14-25)23-12-10-16-15-24-19-9-3-2-7-17(16)19/h2-3,6-9,11,15,24H,1,4-5,10,12-14H2,(H,23,26)
InChIKeyMIGWUZDVBMOKNE-UHFFFAOYSA-N
XLogP3.53
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.45
LogP ≤ 53.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(1H-indol-3-yl)ethyl]-4-pyrrolidin-1-ylpyridine-2-carboxamide
CID 109203848
6-(azepan-1-yl)-N-[2-(1H-indol-3-yl)ethyl]pyridazine-3-carboxamide
CID 109123273
N-[2-(2,3-dichlorophenyl)ethyl]-2-piperidin-1-ylpyridine-3-carboxamide
CID 55799150
6-(cyclohexylamino)-N-[2-(1H-indol-3-yl)ethyl]pyridine-3-carboxamide
CID 109152401
6-(cycloheptylamino)-N-[2-(1H-indol-3-yl)ethyl]pyridine-3-carboxamide
CID 109159738
3-bromo-N-[2-(1H-indol-3-yl)ethyl]pyridine-2-carboxamide
CID 107518048
2-[2-(1H-indol-3-yl)ethylcarbamoyl]cyclohexene-1-carboxylic acid
CID 53270372
2-(4-benzylpiperazin-1-yl)-N-[3-(1H-indol-3-yl)propanoyl]pyridine-3-carboxamide
CID 70030700
2,3-dichloro-N-[2-(1H-indol-3-yl)ethyl]benzamide
CID 27645249
N-[2-(1H-indol-3-yl)ethyl]-1-methyl-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7619624
1-N,4-N-bis[2-(1H-indol-3-yl)ethyl]benzene-1,4-dicarboxamide
CID 42988811
N-[2-(1H-indol-3-yl)ethyl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)acetamide
CID 8595951

Frequently Asked Questions

What is the IUPAC name of N-[2-(1H-indol-3-yl)ethyl]-2-piperidin-1-ylpyridine-3-carboxamide?
The IUPAC name of N-[2-(1H-indol-3-yl)ethyl]-2-piperidin-1-ylpyridine-3-carboxamide (CID 84576774) is N-[2-(1H-indol-3-yl)ethyl]-2-piperidin-1-ylpyridine-3-carboxamide.
What is the SMILES notation for N-[2-(1H-indol-3-yl)ethyl]-2-piperidin-1-ylpyridine-3-carboxamide?
The canonical SMILES for N-[2-(1H-indol-3-yl)ethyl]-2-piperidin-1-ylpyridine-3-carboxamide is O=C(NCCc1c[nH]c2ccccc12)c1cccnc1N1CCCCC1.
What is the InChIKey of N-[2-(1H-indol-3-yl)ethyl]-2-piperidin-1-ylpyridine-3-carboxamide?
The InChIKey is MIGWUZDVBMOKNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N4O/c26-21(18-8-6-11-22-20(18)25-13-4-1-5-14-25)23-12-10-16-15-24-19-9-3-2-7-17(16)19/h2-3,6-9,11,15,24H,1,4-5,10,12-14H2,(H,23,26).
What are the key properties of N-[2-(1H-indol-3-yl)ethyl]-2-piperidin-1-ylpyridine-3-carboxamide?
N-[2-(1H-indol-3-yl)ethyl]-2-piperidin-1-ylpyridine-3-carboxamide has a molecular weight of 348.45 g/mol, XLogP of 3.53, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1H-indol-3-yl)ethyl]-2-piperidin-1-ylpyridine-3-carboxamide is sourced from PubChem (CID 84576774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).