N-[1-(1-benzofuran-2-yl)ethyl]morpholine-3-carboxamide;hydrochloride

C15H19ClN2O3 — CID 119691689

IUPACN-[1-(1-benzofuran-2-yl)ethyl]morpholine-3-carboxamide;hydrochloride
SMILESCC(NC(=O)C1COCCN1)c1cc2ccccc2o1.Cl
InChIInChI=1S/C15H18N2O3.ClH/c1-10(17-15(18)12-9-19-7-6-16-12)14-8-11-4-2-3-5-13(11)20-14;/h2-5,8,10,12,16H,6-7,9H2,1H3,(H,17,18);1H
InChIKeyWVMMDRPZUFQWPA-UHFFFAOYSA-N
MW310.78 g/mol
LogP2.02
Rot. Bonds3

About N-[1-(1-benzofuran-2-yl)ethyl]morpholine-3-carboxamide;hydrochloride

N-[1-(1-benzofuran-2-yl)ethyl]morpholine-3-carboxamide;hydrochloride (PubChem CID 119691689) has the molecular formula C15H19ClN2O3 and a molecular weight of 310.78 g/mol. Its IUPAC name is N-[1-(1-benzofuran-2-yl)ethyl]morpholine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-[1-(1-benzofuran-2-yl)ethyl]morpholine-3-carboxamide;hydrochloride
PubChem CID119691689
Molecular FormulaC15H19ClN2O3
Molecular Weight310.78 g/mol
Exact Mass310.11
IUPAC NameN-[1-(1-benzofuran-2-yl)ethyl]morpholine-3-carboxamide;hydrochloride
SMILESCC(NC(=O)C1COCCN1)c1cc2ccccc2o1.Cl
InChIInChI=1S/C15H18N2O3.ClH/c1-10(17-15(18)12-9-19-7-6-16-12)14-8-11-4-2-3-5-13(11)20-14;/h2-5,8,10,12,16H,6-7,9H2,1H3,(H,17,18);1H
InChIKeyWVMMDRPZUFQWPA-UHFFFAOYSA-N
XLogP2.02
TPSA63.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.78
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-N-[1-(1-benzofuran-2-yl)ethyl]pyrrolidine-2-carboxamide;hydrochloride
CID 119272386
N-[1-(1-benzofuran-2-yl)ethyl]-4-methylpiperidine-2-carboxamide
CID 114423092
(2R,3S)-N-[1-(1-benzofuran-2-yl)ethyl]-2-methylmorpholine-3-carboxamide;hydrochloride
CID 120919673
(3R)-N-[(1S)-1-phenylethyl]morpholine-3-carboxamide
CID 16681349
N-[1-(2-methylphenyl)ethyl]morpholine-3-carboxamide;hydrochloride
CID 119686030
N-[(1R)-1-(1-benzofuran-2-yl)ethyl]cyclobutanecarboxamide
CID 9366149
N-[1-(1-benzofuran-2-yl)ethyl]-3-methylpyrrolidine-2-carboxamide
CID 102778029
N-[1-(1-benzofuran-2-yl)ethyl]-2-hydroxycyclopentane-1-carboxamide
CID 110013757
N-[1-(4-phenyl-1,3-thiazol-2-yl)ethyl]morpholine-3-carboxamide;hydrochloride
CID 119778931
N-[1-(1-benzofuran-2-yl)ethyl]bicyclo[2.2.1]heptane-2-carboxamide
CID 43034290
N-[(1S)-1-(1-benzofuran-2-yl)ethyl]-1-benzofuran-2-carboxamide
CID 9366960
N-[(1R)-1-(1-benzofuran-2-yl)ethyl]-1-benzofuran-2-carboxamide
CID 9366962

Frequently Asked Questions

What is the IUPAC name of N-[1-(1-benzofuran-2-yl)ethyl]morpholine-3-carboxamide;hydrochloride?
The IUPAC name of N-[1-(1-benzofuran-2-yl)ethyl]morpholine-3-carboxamide;hydrochloride (CID 119691689) is N-[1-(1-benzofuran-2-yl)ethyl]morpholine-3-carboxamide;hydrochloride.
What is the SMILES notation for N-[1-(1-benzofuran-2-yl)ethyl]morpholine-3-carboxamide;hydrochloride?
The canonical SMILES for N-[1-(1-benzofuran-2-yl)ethyl]morpholine-3-carboxamide;hydrochloride is CC(NC(=O)C1COCCN1)c1cc2ccccc2o1.Cl.
What is the InChIKey of N-[1-(1-benzofuran-2-yl)ethyl]morpholine-3-carboxamide;hydrochloride?
The InChIKey is WVMMDRPZUFQWPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O3.ClH/c1-10(17-15(18)12-9-19-7-6-16-12)14-8-11-4-2-3-5-13(11)20-14;/h2-5,8,10,12,16H,6-7,9H2,1H3,(H,17,18);1H.
What are the key properties of N-[1-(1-benzofuran-2-yl)ethyl]morpholine-3-carboxamide;hydrochloride?
N-[1-(1-benzofuran-2-yl)ethyl]morpholine-3-carboxamide;hydrochloride has a molecular weight of 310.78 g/mol, XLogP of 2.02, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(1-benzofuran-2-yl)ethyl]morpholine-3-carboxamide;hydrochloride is sourced from PubChem (CID 119691689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).