6-N-[2-(dimethylamino)ethyl]-2-N-[2-(1H-indol-3-yl)ethyl]pyridine-2,6-dicarboxamide

C21H25N5O2 — CID 109096308

IUPAC6-N-[2-(dimethylamino)ethyl]-2-N-[2-(1H-indol-3-yl)ethyl]pyridine-2,6-dicarboxamide
SMILESCN(C)CCNC(=O)c1cccc(C(=O)NCCc2c[nH]c3ccccc23)n1
InChIInChI=1S/C21H25N5O2/c1-26(2)13-12-23-21(28)19-9-5-8-18(25-19)20(27)22-11-10-15-14-24-17-7-4-3-6-16(15)17/h3-9,14,24H,10-13H2,1-2H3,(H,22,27)(H,23,28)
InChIKeyVVAUMYCBJQIKST-UHFFFAOYSA-N
MW379.46 g/mol
LogP1.83
Rot. Bonds8

About 6-N-[2-(dimethylamino)ethyl]-2-N-[2-(1H-indol-3-yl)ethyl]pyridine-2,6-dicarboxamide

6-N-[2-(dimethylamino)ethyl]-2-N-[2-(1H-indol-3-yl)ethyl]pyridine-2,6-dicarboxamide (PubChem CID 109096308) has the molecular formula C21H25N5O2 and a molecular weight of 379.46 g/mol. Its IUPAC name is 6-N-[2-(dimethylamino)ethyl]-2-N-[2-(1H-indol-3-yl)ethyl]pyridine-2,6-dicarboxamide.

Molecular Properties

Compound Name6-N-[2-(dimethylamino)ethyl]-2-N-[2-(1H-indol-3-yl)ethyl]pyridine-2,6-dicarboxamide
PubChem CID109096308
Molecular FormulaC21H25N5O2
Molecular Weight379.46 g/mol
Exact Mass379.20
IUPAC Name6-N-[2-(dimethylamino)ethyl]-2-N-[2-(1H-indol-3-yl)ethyl]pyridine-2,6-dicarboxamide
SMILESCN(C)CCNC(=O)c1cccc(C(=O)NCCc2c[nH]c3ccccc23)n1
InChIInChI=1S/C21H25N5O2/c1-26(2)13-12-23-21(28)19-9-5-8-18(25-19)20(27)22-11-10-15-14-24-17-7-4-3-6-16(15)17/h3-9,14,24H,10-13H2,1-2H3,(H,22,27)(H,23,28)
InChIKeyVVAUMYCBJQIKST-UHFFFAOYSA-N
XLogP1.83
TPSA90.12 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.46
LogP ≤ 51.83
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(dimethylamino)ethyl]-2-[2-(1H-indol-3-yl)ethylamino]pyrimidine-4-carboxamide
CID 109301265
N-[2-(dimethylamino)ethyl]-5-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide
CID 109185316
1-[2-(dimethylamino)ethyl]-3-[2-(1H-indol-3-yl)ethyl]thiourea
CID 8669325
1-N'-[2-(dimethylamino)ethyl]-1-N-[2-(1H-indol-3-yl)ethyl]cyclopropane-1,1-dicarboxamide
CID 108973434
N-[2-(dimethylamino)ethyl]-2-[2-(1H-indol-3-yl)ethylamino]pyridine-4-carboxamide
CID 109167678
2-[3-(dimethylamino)propylamino]-N-[2-(1H-indol-3-yl)ethyl]acetamide
CID 108995075
2-(diethylamino)-N-[2-(1H-indol-3-yl)ethyl]pyrimidine-4-carboxamide
CID 109309635
1-N,4-N-bis[2-(1H-indol-3-yl)ethyl]benzene-1,4-dicarboxamide
CID 42988811
N-[2-(1H-indol-3-yl)ethyl]-6-methylpyrazine-2-carboxamide
CID 146080613
N-[2-(1H-indol-3-yl)ethyl]-2,4,6-trimethylpyrimidine-5-carboxamide
CID 110853427
N-[2-(1H-indol-3-yl)ethyl]-1-methyltriazole-4-carboxamide
CID 45497188
6-chloro-N-[2-(1H-indol-3-yl)ethyl]pyrazine-2-carboxamide
CID 103186743

Frequently Asked Questions

What is the IUPAC name of 6-N-[2-(dimethylamino)ethyl]-2-N-[2-(1H-indol-3-yl)ethyl]pyridine-2,6-dicarboxamide?
The IUPAC name of 6-N-[2-(dimethylamino)ethyl]-2-N-[2-(1H-indol-3-yl)ethyl]pyridine-2,6-dicarboxamide (CID 109096308) is 6-N-[2-(dimethylamino)ethyl]-2-N-[2-(1H-indol-3-yl)ethyl]pyridine-2,6-dicarboxamide.
What is the SMILES notation for 6-N-[2-(dimethylamino)ethyl]-2-N-[2-(1H-indol-3-yl)ethyl]pyridine-2,6-dicarboxamide?
The canonical SMILES for 6-N-[2-(dimethylamino)ethyl]-2-N-[2-(1H-indol-3-yl)ethyl]pyridine-2,6-dicarboxamide is CN(C)CCNC(=O)c1cccc(C(=O)NCCc2c[nH]c3ccccc23)n1.
What is the InChIKey of 6-N-[2-(dimethylamino)ethyl]-2-N-[2-(1H-indol-3-yl)ethyl]pyridine-2,6-dicarboxamide?
The InChIKey is VVAUMYCBJQIKST-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N5O2/c1-26(2)13-12-23-21(28)19-9-5-8-18(25-19)20(27)22-11-10-15-14-24-17-7-4-3-6-16(15)17/h3-9,14,24H,10-13H2,1-2H3,(H,22,27)(H,23,28).
What are the key properties of 6-N-[2-(dimethylamino)ethyl]-2-N-[2-(1H-indol-3-yl)ethyl]pyridine-2,6-dicarboxamide?
6-N-[2-(dimethylamino)ethyl]-2-N-[2-(1H-indol-3-yl)ethyl]pyridine-2,6-dicarboxamide has a molecular weight of 379.46 g/mol, XLogP of 1.83, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-[2-(dimethylamino)ethyl]-2-N-[2-(1H-indol-3-yl)ethyl]pyridine-2,6-dicarboxamide is sourced from PubChem (CID 109096308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).