N-(2-morpholin-4-ylethyl)-1-benzofuran-2-carboxamide;hydrochloride

C15H19ClN2O3 — CID 2952496

IUPACN-(2-morpholin-4-ylethyl)-1-benzofuran-2-carboxamide;hydrochloride
SMILESCl.O=C(NCCN1CCOCC1)c1cc2ccccc2o1
InChIInChI=1S/C15H18N2O3.ClH/c18-15(16-5-6-17-7-9-19-10-8-17)14-11-12-3-1-2-4-13(12)20-14;/h1-4,11H,5-10H2,(H,16,18);1H
InChIKeyYCTODCUPTIIPHD-UHFFFAOYSA-N
MW310.78 g/mol
LogP1.92
Rot. Bonds4

About N-(2-morpholin-4-ylethyl)-1-benzofuran-2-carboxamide;hydrochloride

N-(2-morpholin-4-ylethyl)-1-benzofuran-2-carboxamide;hydrochloride (PubChem CID 2952496) has the molecular formula C15H19ClN2O3 and a molecular weight of 310.78 g/mol. Its IUPAC name is N-(2-morpholin-4-ylethyl)-1-benzofuran-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(2-morpholin-4-ylethyl)-1-benzofuran-2-carboxamide;hydrochloride
PubChem CID2952496
Molecular FormulaC15H19ClN2O3
Molecular Weight310.78 g/mol
Exact Mass310.11
IUPAC NameN-(2-morpholin-4-ylethyl)-1-benzofuran-2-carboxamide;hydrochloride
SMILESCl.O=C(NCCN1CCOCC1)c1cc2ccccc2o1
InChIInChI=1S/C15H18N2O3.ClH/c18-15(16-5-6-17-7-9-19-10-8-17)14-11-12-3-1-2-4-13(12)20-14;/h1-4,11H,5-10H2,(H,16,18);1H
InChIKeyYCTODCUPTIIPHD-UHFFFAOYSA-N
XLogP1.92
TPSA54.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.78
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-ylethyl)-1-benzofuran-2-carboxamide;hydrochloride?
The IUPAC name of N-(2-morpholin-4-ylethyl)-1-benzofuran-2-carboxamide;hydrochloride (CID 2952496) is N-(2-morpholin-4-ylethyl)-1-benzofuran-2-carboxamide;hydrochloride.
What is the SMILES notation for N-(2-morpholin-4-ylethyl)-1-benzofuran-2-carboxamide;hydrochloride?
The canonical SMILES for N-(2-morpholin-4-ylethyl)-1-benzofuran-2-carboxamide;hydrochloride is Cl.O=C(NCCN1CCOCC1)c1cc2ccccc2o1.
What is the InChIKey of N-(2-morpholin-4-ylethyl)-1-benzofuran-2-carboxamide;hydrochloride?
The InChIKey is YCTODCUPTIIPHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O3.ClH/c18-15(16-5-6-17-7-9-19-10-8-17)14-11-12-3-1-2-4-13(12)20-14;/h1-4,11H,5-10H2,(H,16,18);1H.
What are the key properties of N-(2-morpholin-4-ylethyl)-1-benzofuran-2-carboxamide;hydrochloride?
N-(2-morpholin-4-ylethyl)-1-benzofuran-2-carboxamide;hydrochloride has a molecular weight of 310.78 g/mol, XLogP of 1.92, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-ylethyl)-1-benzofuran-2-carboxamide;hydrochloride is sourced from PubChem (CID 2952496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).