N-benzyl-N-ethyl-5-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide

C25H26N4O — CID 109190713

IUPACN-benzyl-N-ethyl-5-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide
SMILESCCN(Cc1ccccc1)C(=O)c1ccc(NCCc2c[nH]c3ccccc23)cn1
InChIInChI=1S/C25H26N4O/c1-2-29(18-19-8-4-3-5-9-19)25(30)24-13-12-21(17-28-24)26-15-14-20-16-27-23-11-7-6-10-22(20)23/h3-13,16-17,26-27H,2,14-15,18H2,1H3
InChIKeyIVZVHLIJMXUYEN-UHFFFAOYSA-N
MW398.51 g/mol
LogP4.88
Rot. Bonds8

About N-benzyl-N-ethyl-5-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide

N-benzyl-N-ethyl-5-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide (PubChem CID 109190713) has the molecular formula C25H26N4O and a molecular weight of 398.51 g/mol. Its IUPAC name is N-benzyl-N-ethyl-5-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-benzyl-N-ethyl-5-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide
PubChem CID109190713
Molecular FormulaC25H26N4O
Molecular Weight398.51 g/mol
Exact Mass398.21
IUPAC NameN-benzyl-N-ethyl-5-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide
SMILESCCN(Cc1ccccc1)C(=O)c1ccc(NCCc2c[nH]c3ccccc23)cn1
InChIInChI=1S/C25H26N4O/c1-2-29(18-19-8-4-3-5-9-19)25(30)24-13-12-21(17-28-24)26-15-14-20-16-27-23-11-7-6-10-22(20)23/h3-13,16-17,26-27H,2,14-15,18H2,1H3
InChIKeyIVZVHLIJMXUYEN-UHFFFAOYSA-N
XLogP4.88
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.51
LogP ≤ 54.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-benzyl-N-ethyl-5-[2-(2-methoxyphenyl)ethylamino]pyridine-2-carboxamide
CID 109190707
N-benzyl-5-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide
CID 109187851
N-benzyl-N-ethyl-2-[2-(1H-indol-3-yl)ethylamino]pyridine-4-carboxamide
CID 109171507
N,N-diethyl-4-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide
CID 109215333
N-[2-(dimethylamino)ethyl]-5-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide
CID 109185316
N-benzyl-5-[2-(3-chlorophenyl)ethylamino]-N-ethylpyridine-2-carboxamide
CID 109190728
5-(benzylamino)-N-[2-(1H-indol-3-yl)ethyl]pyridine-2-carboxamide
CID 109188002
N-[(4-fluorophenyl)methyl]-5-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide
CID 109189607
N-benzyl-5-(tert-butylamino)-N-ethylpyridine-2-carboxamide
CID 109190719
N,N-diethyl-6-[2-(1H-indol-3-yl)ethylamino]pyridine-3-carboxamide
CID 109159691
N-benzyl-N-ethyl-5-(pyridin-2-ylmethylamino)pyridine-2-carboxamide
CID 109190700
N-[2-(1H-indol-3-yl)ethyl]-5-(pyridin-3-ylmethylamino)pyridine-2-carboxamide
CID 109191325

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-ethyl-5-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide?
The IUPAC name of N-benzyl-N-ethyl-5-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide (CID 109190713) is N-benzyl-N-ethyl-5-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide.
What is the SMILES notation for N-benzyl-N-ethyl-5-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide?
The canonical SMILES for N-benzyl-N-ethyl-5-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide is CCN(Cc1ccccc1)C(=O)c1ccc(NCCc2c[nH]c3ccccc23)cn1.
What is the InChIKey of N-benzyl-N-ethyl-5-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide?
The InChIKey is IVZVHLIJMXUYEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N4O/c1-2-29(18-19-8-4-3-5-9-19)25(30)24-13-12-21(17-28-24)26-15-14-20-16-27-23-11-7-6-10-22(20)23/h3-13,16-17,26-27H,2,14-15,18H2,1H3.
What are the key properties of N-benzyl-N-ethyl-5-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide?
N-benzyl-N-ethyl-5-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide has a molecular weight of 398.51 g/mol, XLogP of 4.88, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-ethyl-5-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide is sourced from PubChem (CID 109190713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).