2-N,6-N-bis[2-(dimethylamino)-2-(furan-2-yl)ethyl]pyridine-2,6-dicarboxamide

C23H29N5O4 — CID 46604974

IUPAC2-N,6-N-bis[2-(dimethylamino)-2-(furan-2-yl)ethyl]pyridine-2,6-dicarboxamide
SMILESCN(C)C(CNC(=O)c1cccc(C(=O)NCC(c2ccco2)N(C)C)n1)c1ccco1
InChIInChI=1S/C23H29N5O4/c1-27(2)18(20-10-6-12-31-20)14-24-22(29)16-8-5-9-17(26-16)23(30)25-15-19(28(3)4)21-11-7-13-32-21/h5-13,18-19H,14-15H2,1-4H3,(H,24,29)(H,25,30)
InChIKeyYXRHKCVSWUWEBD-UHFFFAOYSA-N
MW439.52 g/mol
LogP2.33
Rot. Bonds10

About 2-N,6-N-bis[2-(dimethylamino)-2-(furan-2-yl)ethyl]pyridine-2,6-dicarboxamide

2-N,6-N-bis[2-(dimethylamino)-2-(furan-2-yl)ethyl]pyridine-2,6-dicarboxamide (PubChem CID 46604974) has the molecular formula C23H29N5O4 and a molecular weight of 439.52 g/mol. Its IUPAC name is 2-N,6-N-bis[2-(dimethylamino)-2-(furan-2-yl)ethyl]pyridine-2,6-dicarboxamide.

Molecular Properties

Compound Name2-N,6-N-bis[2-(dimethylamino)-2-(furan-2-yl)ethyl]pyridine-2,6-dicarboxamide
PubChem CID46604974
Molecular FormulaC23H29N5O4
Molecular Weight439.52 g/mol
Exact Mass439.22
IUPAC Name2-N,6-N-bis[2-(dimethylamino)-2-(furan-2-yl)ethyl]pyridine-2,6-dicarboxamide
SMILESCN(C)C(CNC(=O)c1cccc(C(=O)NCC(c2ccco2)N(C)C)n1)c1ccco1
InChIInChI=1S/C23H29N5O4/c1-27(2)18(20-10-6-12-31-20)14-24-22(29)16-8-5-9-17(26-16)23(30)25-15-19(28(3)4)21-11-7-13-32-21/h5-13,18-19H,14-15H2,1-4H3,(H,24,29)(H,25,30)
InChIKeyYXRHKCVSWUWEBD-UHFFFAOYSA-N
XLogP2.33
TPSA103.85 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds10
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500439.52
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]quinoline-2-carboxamide
CID 51162742
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CID 47447577
2-acetamido-N-[(2R)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-1,3-thiazole-4-carboxamide
CID 39038795
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]benzamide;hydrochloride
CID 20994951
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2,3-dimethylbenzamide
CID 51162753
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-4-iodobenzamide
CID 51145105
N-[(2R)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-methylbenzamide
CID 26818992
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-iodobenzamide
CID 51145107
3-amino-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]benzamide
CID 61250548
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-fluoro-3-methylbenzamide
CID 80710543
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(4-fluorophenyl)-1,3-thiazole-4-carboxamide
CID 86911956
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-4-fluorobenzamide;hydrochloride
CID 52985207

Frequently Asked Questions

What is the IUPAC name of 2-N,6-N-bis[2-(dimethylamino)-2-(furan-2-yl)ethyl]pyridine-2,6-dicarboxamide?
The IUPAC name of 2-N,6-N-bis[2-(dimethylamino)-2-(furan-2-yl)ethyl]pyridine-2,6-dicarboxamide (CID 46604974) is 2-N,6-N-bis[2-(dimethylamino)-2-(furan-2-yl)ethyl]pyridine-2,6-dicarboxamide.
What is the SMILES notation for 2-N,6-N-bis[2-(dimethylamino)-2-(furan-2-yl)ethyl]pyridine-2,6-dicarboxamide?
The canonical SMILES for 2-N,6-N-bis[2-(dimethylamino)-2-(furan-2-yl)ethyl]pyridine-2,6-dicarboxamide is CN(C)C(CNC(=O)c1cccc(C(=O)NCC(c2ccco2)N(C)C)n1)c1ccco1.
What is the InChIKey of 2-N,6-N-bis[2-(dimethylamino)-2-(furan-2-yl)ethyl]pyridine-2,6-dicarboxamide?
The InChIKey is YXRHKCVSWUWEBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H29N5O4/c1-27(2)18(20-10-6-12-31-20)14-24-22(29)16-8-5-9-17(26-16)23(30)25-15-19(28(3)4)21-11-7-13-32-21/h5-13,18-19H,14-15H2,1-4H3,(H,24,29)(H,25,30).
What are the key properties of 2-N,6-N-bis[2-(dimethylamino)-2-(furan-2-yl)ethyl]pyridine-2,6-dicarboxamide?
2-N,6-N-bis[2-(dimethylamino)-2-(furan-2-yl)ethyl]pyridine-2,6-dicarboxamide has a molecular weight of 439.52 g/mol, XLogP of 2.33, 10 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,6-N-bis[2-(dimethylamino)-2-(furan-2-yl)ethyl]pyridine-2,6-dicarboxamide is sourced from PubChem (CID 46604974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).