1-(1-benzofuran-2-yl)-3-morpholin-4-ylpropan-1-one;hydrochloride

C15H18ClNO3 — CID 14509721

IUPAC1-(1-benzofuran-2-yl)-3-morpholin-4-ylpropan-1-one;hydrochloride
SMILESCl.O=C(CCN1CCOCC1)c1cc2ccccc2o1
InChIInChI=1S/C15H17NO3.ClH/c17-13(5-6-16-7-9-18-10-8-16)15-11-12-3-1-2-4-14(12)19-15;/h1-4,11H,5-10H2;1H
InChIKeyLTNFGZWEPWNKFS-UHFFFAOYSA-N
MW295.77 g/mol
LogP2.76
Rot. Bonds4

About 1-(1-benzofuran-2-yl)-3-morpholin-4-ylpropan-1-one;hydrochloride

1-(1-benzofuran-2-yl)-3-morpholin-4-ylpropan-1-one;hydrochloride (PubChem CID 14509721) has the molecular formula C15H18ClNO3 and a molecular weight of 295.77 g/mol. Its IUPAC name is 1-(1-benzofuran-2-yl)-3-morpholin-4-ylpropan-1-one;hydrochloride.

Molecular Properties

Compound Name1-(1-benzofuran-2-yl)-3-morpholin-4-ylpropan-1-one;hydrochloride
PubChem CID14509721
Molecular FormulaC15H18ClNO3
Molecular Weight295.77 g/mol
Exact Mass295.10
IUPAC Name1-(1-benzofuran-2-yl)-3-morpholin-4-ylpropan-1-one;hydrochloride
SMILESCl.O=C(CCN1CCOCC1)c1cc2ccccc2o1
InChIInChI=1S/C15H17NO3.ClH/c17-13(5-6-16-7-9-18-10-8-16)15-11-12-3-1-2-4-14(12)19-15;/h1-4,11H,5-10H2;1H
InChIKeyLTNFGZWEPWNKFS-UHFFFAOYSA-N
XLogP2.76
TPSA42.68 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.77
LogP ≤ 52.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-(1-benzofuran-2-yl)-3-(4-methylpiperazin-1-yl)propan-1-one;dihydrochloride
CID 71757920
1-(1-benzofuran-2-yl)-2-(1,4-oxazepan-4-yl)ethanone
CID 62973085
3-morpholin-4-yl-1-naphthalen-2-ylpropan-1-one
CID 2807050
3-amino-1-(1-benzofuran-2-yl)propan-1-one
CID 82275110
1-benzofuran-2-yl-[4-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone
CID 49096129
1-(1-benzofuran-2-yl)-2-(4-phenylpiperazin-1-yl)ethanone
CID 14509719
1-(1-benzofuran-2-yl)-2-(1,3-dihydroisoindol-2-yl)ethanone
CID 62206433
3-(3-piperidin-1-ylpropanoyl)chromen-2-one
CID 25156895
2-[1-[3-(1-benzofuran-2-yl)-3-oxopropyl]pyrrolidin-2-yl]acetic acid
CID 82183506
1-(1-benzofuran-2-yl)-3-(methylamino)propan-1-one
CID 114736388
N-(2-morpholin-4-ylethyl)benzo[e][1]benzofuran-2-carboxamide
CID 6460423
4-(1-benzofuran-2-carbonyl)-5-(4-methylphenyl)-1-(2-morpholin-4-ylethyl)pyrrolidine-2,3-dione
CID 91897632

Frequently Asked Questions

What is the IUPAC name of 1-(1-benzofuran-2-yl)-3-morpholin-4-ylpropan-1-one;hydrochloride?
The IUPAC name of 1-(1-benzofuran-2-yl)-3-morpholin-4-ylpropan-1-one;hydrochloride (CID 14509721) is 1-(1-benzofuran-2-yl)-3-morpholin-4-ylpropan-1-one;hydrochloride.
What is the SMILES notation for 1-(1-benzofuran-2-yl)-3-morpholin-4-ylpropan-1-one;hydrochloride?
The canonical SMILES for 1-(1-benzofuran-2-yl)-3-morpholin-4-ylpropan-1-one;hydrochloride is Cl.O=C(CCN1CCOCC1)c1cc2ccccc2o1.
What is the InChIKey of 1-(1-benzofuran-2-yl)-3-morpholin-4-ylpropan-1-one;hydrochloride?
The InChIKey is LTNFGZWEPWNKFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO3.ClH/c17-13(5-6-16-7-9-18-10-8-16)15-11-12-3-1-2-4-14(12)19-15;/h1-4,11H,5-10H2;1H.
What are the key properties of 1-(1-benzofuran-2-yl)-3-morpholin-4-ylpropan-1-one;hydrochloride?
1-(1-benzofuran-2-yl)-3-morpholin-4-ylpropan-1-one;hydrochloride has a molecular weight of 295.77 g/mol, XLogP of 2.76, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-benzofuran-2-yl)-3-morpholin-4-ylpropan-1-one;hydrochloride is sourced from PubChem (CID 14509721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).