N-(2-morpholin-4-yl-2-pyridin-3-ylethyl)furan-2-carboxamide

C16H19N3O3 — CID 3241753

IUPACN-(2-morpholin-4-yl-2-pyridin-3-ylethyl)furan-2-carboxamide
SMILESO=C(NCC(c1cccnc1)N1CCOCC1)c1ccco1
InChIInChI=1S/C16H19N3O3/c20-16(15-4-2-8-22-15)18-12-14(13-3-1-5-17-11-13)19-6-9-21-10-7-19/h1-5,8,11,14H,6-7,9-10,12H2,(H,18,20)
InChIKeyBWRSXBQALWLEAB-UHFFFAOYSA-N
MW301.35 g/mol
LogP1.48
Rot. Bonds5

About N-(2-morpholin-4-yl-2-pyridin-3-ylethyl)furan-2-carboxamide

N-(2-morpholin-4-yl-2-pyridin-3-ylethyl)furan-2-carboxamide (PubChem CID 3241753) has the molecular formula C16H19N3O3 and a molecular weight of 301.35 g/mol. Its IUPAC name is N-(2-morpholin-4-yl-2-pyridin-3-ylethyl)furan-2-carboxamide.

Molecular Properties

Compound NameN-(2-morpholin-4-yl-2-pyridin-3-ylethyl)furan-2-carboxamide
PubChem CID3241753
Molecular FormulaC16H19N3O3
Molecular Weight301.35 g/mol
Exact Mass301.14
IUPAC NameN-(2-morpholin-4-yl-2-pyridin-3-ylethyl)furan-2-carboxamide
SMILESO=C(NCC(c1cccnc1)N1CCOCC1)c1ccco1
InChIInChI=1S/C16H19N3O3/c20-16(15-4-2-8-22-15)18-12-14(13-3-1-5-17-11-13)19-6-9-21-10-7-19/h1-5,8,11,14H,6-7,9-10,12H2,(H,18,20)
InChIKeyBWRSXBQALWLEAB-UHFFFAOYSA-N
XLogP1.48
TPSA67.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.35
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-yl-2-pyridin-3-ylethyl)furan-2-carboxamide?
The IUPAC name of N-(2-morpholin-4-yl-2-pyridin-3-ylethyl)furan-2-carboxamide (CID 3241753) is N-(2-morpholin-4-yl-2-pyridin-3-ylethyl)furan-2-carboxamide.
What is the SMILES notation for N-(2-morpholin-4-yl-2-pyridin-3-ylethyl)furan-2-carboxamide?
The canonical SMILES for N-(2-morpholin-4-yl-2-pyridin-3-ylethyl)furan-2-carboxamide is O=C(NCC(c1cccnc1)N1CCOCC1)c1ccco1.
What is the InChIKey of N-(2-morpholin-4-yl-2-pyridin-3-ylethyl)furan-2-carboxamide?
The InChIKey is BWRSXBQALWLEAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O3/c20-16(15-4-2-8-22-15)18-12-14(13-3-1-5-17-11-13)19-6-9-21-10-7-19/h1-5,8,11,14H,6-7,9-10,12H2,(H,18,20).
What are the key properties of N-(2-morpholin-4-yl-2-pyridin-3-ylethyl)furan-2-carboxamide?
N-(2-morpholin-4-yl-2-pyridin-3-ylethyl)furan-2-carboxamide has a molecular weight of 301.35 g/mol, XLogP of 1.48, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-yl-2-pyridin-3-ylethyl)furan-2-carboxamide is sourced from PubChem (CID 3241753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).