N-[(E)-2-(dimethylamino)ethenyl]-3-[(5-hydroxynaphthalen-2-yl)amino]furo[2,3-c]pyridine-2-carboxamide

C22H20N4O3 — CID 53321929

About N-[(E)-2-(dimethylamino)ethenyl]-3-[(5-hydroxynaphthalen-2-yl)amino]furo[2,3-c]pyridine-2-carboxamide

N-[(E)-2-(dimethylamino)ethenyl]-3-[(5-hydroxynaphthalen-2-yl)amino]furo[2,3-c]pyridine-2-carboxamide (PubChem CID 53321929) has the molecular formula C22H20N4O3 and a molecular weight of 388.43 g/mol. Its IUPAC name is N-[(E)-2-(dimethylamino)ethenyl]-3-[(5-hydroxynaphthalen-2-yl)amino]furo[2,3-c]pyridine-2-carboxamide.

Molecular Properties

• Compound Name: N-[(E)-2-(dimethylamino)ethenyl]-3-[(5-hydroxynaphthalen-2-yl)amino]furo[2,3-c]pyridine-2-carboxamide
• PubChem CID: 53321929
• Molecular Formula: C22H20N4O3
• Molecular Weight: 388.43 g/mol
• Exact Mass: 388.15
• IUPAC Name: N-[(E)-2-(dimethylamino)ethenyl]-3-[(5-hydroxynaphthalen-2-yl)amino]furo[2,3-c]pyridine-2-carboxamide
• SMILES: CN(C)/C=C/NC(=O)c1oc2cnccc2c1Nc1ccc2c(O)cccc2c1
• InChI: InChI=1S/C22H20N4O3/c1-26(2)11-10-24-22(28)21-20(17-8-9-23-13-19(17)29-21)25-15-6-7-16-14(12-15)4-3-5-18(16)27/h3-13,25,27H,1-2H3,(H,24,28)/b11-10+
• InChIKey: ODAKYRNOKBCGQV-ZHACJKMWSA-N
• XLogP: 4.19
• TPSA: 90.63 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 6
• Rotatable Bonds: 5
• Heavy Atoms: 29
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	388.43
LogP ≤ 5	4.19
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of N-[(E)-2-(dimethylamino)ethenyl]-3-[(5-hydroxynaphthalen-2-yl)amino]furo[2,3-c]pyridine-2-carboxamide?

The IUPAC name of N-[(E)-2-(dimethylamino)ethenyl]-3-[(5-hydroxynaphthalen-2-yl)amino]furo[2,3-c]pyridine-2-carboxamide (CID 53321929) is N-[(E)-2-(dimethylamino)ethenyl]-3-[(5-hydroxynaphthalen-2-yl)amino]furo[2,3-c]pyridine-2-carboxamide.

What is the SMILES notation for N-[(E)-2-(dimethylamino)ethenyl]-3-[(5-hydroxynaphthalen-2-yl)amino]furo[2,3-c]pyridine-2-carboxamide?

The canonical SMILES for N-[(E)-2-(dimethylamino)ethenyl]-3-[(5-hydroxynaphthalen-2-yl)amino]furo[2,3-c]pyridine-2-carboxamide is CN(C)/C=C/NC(=O)c1oc2cnccc2c1Nc1ccc2c(O)cccc2c1.

What is the InChIKey of N-[(E)-2-(dimethylamino)ethenyl]-3-[(5-hydroxynaphthalen-2-yl)amino]furo[2,3-c]pyridine-2-carboxamide?

The InChIKey is ODAKYRNOKBCGQV-ZHACJKMWSA-N. The full InChI is InChI=1S/C22H20N4O3/c1-26(2)11-10-24-22(28)21-20(17-8-9-23-13-19(17)29-21)25-15-6-7-16-14(12-15)4-3-5-18(16)27/h3-13,25,27H,1-2H3,(H,24,28)/b11-10+.

What are the key properties of N-[(E)-2-(dimethylamino)ethenyl]-3-[(5-hydroxynaphthalen-2-yl)amino]furo[2,3-c]pyridine-2-carboxamide?

N-[(E)-2-(dimethylamino)ethenyl]-3-[(5-hydroxynaphthalen-2-yl)amino]furo[2,3-c]pyridine-2-carboxamide has a molecular weight of 388.43 g/mol, XLogP of 4.19, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for N-[(E)-2-(dimethylamino)ethenyl]-3-[(5-hydroxynaphthalen-2-yl)amino]furo[2,3-c]pyridine-2-carboxamide is sourced from PubChem (CID 53321929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).