N-(furan-2-ylmethyl)-6-[2-(1H-indol-3-yl)ethylamino]pyridine-3-carboxamide

C21H20N4O2 — CID 109155396

IUPACN-(furan-2-ylmethyl)-6-[2-(1H-indol-3-yl)ethylamino]pyridine-3-carboxamide
SMILESO=C(NCc1ccco1)c1ccc(NCCc2c[nH]c3ccccc23)nc1
InChIInChI=1S/C21H20N4O2/c26-21(25-14-17-4-3-11-27-17)16-7-8-20(24-13-16)22-10-9-15-12-23-19-6-2-1-5-18(15)19/h1-8,11-13,23H,9-10,14H2,(H,22,24)(H,25,26)
InChIKeyUGGJBBXOFIJXFQ-UHFFFAOYSA-N
MW360.42 g/mol
LogP3.74
Rot. Bonds7

About N-(furan-2-ylmethyl)-6-[2-(1H-indol-3-yl)ethylamino]pyridine-3-carboxamide

N-(furan-2-ylmethyl)-6-[2-(1H-indol-3-yl)ethylamino]pyridine-3-carboxamide (PubChem CID 109155396) has the molecular formula C21H20N4O2 and a molecular weight of 360.42 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-6-[2-(1H-indol-3-yl)ethylamino]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-6-[2-(1H-indol-3-yl)ethylamino]pyridine-3-carboxamide
PubChem CID109155396
Molecular FormulaC21H20N4O2
Molecular Weight360.42 g/mol
Exact Mass360.16
IUPAC NameN-(furan-2-ylmethyl)-6-[2-(1H-indol-3-yl)ethylamino]pyridine-3-carboxamide
SMILESO=C(NCc1ccco1)c1ccc(NCCc2c[nH]c3ccccc23)nc1
InChIInChI=1S/C21H20N4O2/c26-21(25-14-17-4-3-11-27-17)16-7-8-20(24-13-16)22-10-9-15-12-23-19-6-2-1-5-18(15)19/h1-8,11-13,23H,9-10,14H2,(H,22,24)(H,25,26)
InChIKeyUGGJBBXOFIJXFQ-UHFFFAOYSA-N
XLogP3.74
TPSA82.95 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.42
LogP ≤ 53.74
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

6-[2-(1H-indol-3-yl)ethylamino]-N-(2-methylpropyl)pyridine-3-carboxamide
CID 109151886
N,N-diethyl-6-[2-(1H-indol-3-yl)ethylamino]pyridine-3-carboxamide
CID 109159691
N-[2-(1H-indol-3-yl)ethyl]-6-[(4-methylphenyl)methylamino]pyridine-3-carboxamide
CID 109155968
6-[2-(1H-indol-3-yl)ethylamino]-N-methyl-N-phenylpyridine-3-carboxamide
CID 109159705
N-(3-fluorophenyl)-6-[2-(1H-indol-3-yl)ethylamino]pyridine-3-carboxamide
CID 109159728
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
N-[2-(1H-indol-3-yl)ethyl]-6-(2-methylanilino)pyridine-3-carboxamide
CID 109159746
6-(4-chloroanilino)-N-[2-(1H-indol-3-yl)ethyl]pyridine-3-carboxamide
CID 109159757
2-[2-(1H-indol-3-yl)ethylamino]-N-(pyridin-3-ylmethyl)pyridine-4-carboxamide
CID 109171814
1-N,4-N-bis[2-(1H-indol-3-yl)ethyl]benzene-1,4-dicarboxamide
CID 42988811
6-(2-cyanoanilino)-N-[2-(1H-indol-3-yl)ethyl]pyridine-3-carboxamide
CID 109159767

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-6-[2-(1H-indol-3-yl)ethylamino]pyridine-3-carboxamide?
The IUPAC name of N-(furan-2-ylmethyl)-6-[2-(1H-indol-3-yl)ethylamino]pyridine-3-carboxamide (CID 109155396) is N-(furan-2-ylmethyl)-6-[2-(1H-indol-3-yl)ethylamino]pyridine-3-carboxamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-6-[2-(1H-indol-3-yl)ethylamino]pyridine-3-carboxamide?
The canonical SMILES for N-(furan-2-ylmethyl)-6-[2-(1H-indol-3-yl)ethylamino]pyridine-3-carboxamide is O=C(NCc1ccco1)c1ccc(NCCc2c[nH]c3ccccc23)nc1.
What is the InChIKey of N-(furan-2-ylmethyl)-6-[2-(1H-indol-3-yl)ethylamino]pyridine-3-carboxamide?
The InChIKey is UGGJBBXOFIJXFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N4O2/c26-21(25-14-17-4-3-11-27-17)16-7-8-20(24-13-16)22-10-9-15-12-23-19-6-2-1-5-18(15)19/h1-8,11-13,23H,9-10,14H2,(H,22,24)(H,25,26).
What are the key properties of N-(furan-2-ylmethyl)-6-[2-(1H-indol-3-yl)ethylamino]pyridine-3-carboxamide?
N-(furan-2-ylmethyl)-6-[2-(1H-indol-3-yl)ethylamino]pyridine-3-carboxamide has a molecular weight of 360.42 g/mol, XLogP of 3.74, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-6-[2-(1H-indol-3-yl)ethylamino]pyridine-3-carboxamide is sourced from PubChem (CID 109155396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).