5-chloro-N-(2-morpholin-4-yl-2-phenylethyl)furan-2-carboxamide

C17H19ClN2O3 — CID 86922955

IUPAC5-chloro-N-(2-morpholin-4-yl-2-phenylethyl)furan-2-carboxamide
SMILESO=C(NCC(c1ccccc1)N1CCOCC1)c1ccc(Cl)o1
InChIInChI=1S/C17H19ClN2O3/c18-16-7-6-15(23-16)17(21)19-12-14(13-4-2-1-3-5-13)20-8-10-22-11-9-20/h1-7,14H,8-12H2,(H,19,21)
InChIKeyWPANJTRKJYWEKD-UHFFFAOYSA-N
MW334.80 g/mol
LogP2.74
Rot. Bonds5

About 5-chloro-N-(2-morpholin-4-yl-2-phenylethyl)furan-2-carboxamide

5-chloro-N-(2-morpholin-4-yl-2-phenylethyl)furan-2-carboxamide (PubChem CID 86922955) has the molecular formula C17H19ClN2O3 and a molecular weight of 334.80 g/mol. Its IUPAC name is 5-chloro-N-(2-morpholin-4-yl-2-phenylethyl)furan-2-carboxamide.

Molecular Properties

Compound Name5-chloro-N-(2-morpholin-4-yl-2-phenylethyl)furan-2-carboxamide
PubChem CID86922955
Molecular FormulaC17H19ClN2O3
Molecular Weight334.80 g/mol
Exact Mass334.11
IUPAC Name5-chloro-N-(2-morpholin-4-yl-2-phenylethyl)furan-2-carboxamide
SMILESO=C(NCC(c1ccccc1)N1CCOCC1)c1ccc(Cl)o1
InChIInChI=1S/C17H19ClN2O3/c18-16-7-6-15(23-16)17(21)19-12-14(13-4-2-1-3-5-13)20-8-10-22-11-9-20/h1-7,14H,8-12H2,(H,19,21)
InChIKeyWPANJTRKJYWEKD-UHFFFAOYSA-N
XLogP2.74
TPSA54.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.80
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-chloro-N-[(2S)-2-phenyl-2-pyrrolidin-1-ylethyl]furan-2-carboxamide
CID 30334540
1-[(4-chlorophenyl)methyl]-3-(2-morpholin-4-yl-2-phenylethyl)urea
CID 42890774
6-bromo-N-(2-morpholin-4-yl-2-phenylethyl)-4-oxochromene-2-carboxamide
CID 45155279
2,4-dichloro-N-(2-morpholin-4-yl-2-phenylethyl)benzamide
CID 46578639
3-[(5-chlorofuran-2-carbonyl)amino]-2-phenylpropanoic acid
CID 62883681
N-[2-(4-chlorophenyl)-2-morpholin-4-ylethyl]-1-phenylcyclobutane-1-carboxamide
CID 60596926
1-[(4-fluorophenyl)methyl]-3-(2-morpholin-4-yl-2-phenylethyl)urea
CID 42890407
N-(2-morpholin-4-yl-2-pyridin-3-ylethyl)benzamide
CID 16806482
3-chloro-N-[2-(4-ethylphenyl)-2-morpholin-4-ylethyl]benzamide
CID 112506584
1-amino-N-(2-morpholin-4-yl-2-phenylethyl)cyclohexane-1-carboxamide
CID 119853255
N-[2-(4-chlorophenyl)-2-morpholin-4-ylethyl]-2-(4-fluorophenyl)acetamide
CID 112503799
1-[2-(4-fluorophenyl)ethyl]-3-[(2R)-2-morpholin-4-yl-2-phenylethyl]urea
CID 51934907

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(2-morpholin-4-yl-2-phenylethyl)furan-2-carboxamide?
The IUPAC name of 5-chloro-N-(2-morpholin-4-yl-2-phenylethyl)furan-2-carboxamide (CID 86922955) is 5-chloro-N-(2-morpholin-4-yl-2-phenylethyl)furan-2-carboxamide.
What is the SMILES notation for 5-chloro-N-(2-morpholin-4-yl-2-phenylethyl)furan-2-carboxamide?
The canonical SMILES for 5-chloro-N-(2-morpholin-4-yl-2-phenylethyl)furan-2-carboxamide is O=C(NCC(c1ccccc1)N1CCOCC1)c1ccc(Cl)o1.
What is the InChIKey of 5-chloro-N-(2-morpholin-4-yl-2-phenylethyl)furan-2-carboxamide?
The InChIKey is WPANJTRKJYWEKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19ClN2O3/c18-16-7-6-15(23-16)17(21)19-12-14(13-4-2-1-3-5-13)20-8-10-22-11-9-20/h1-7,14H,8-12H2,(H,19,21).
What are the key properties of 5-chloro-N-(2-morpholin-4-yl-2-phenylethyl)furan-2-carboxamide?
5-chloro-N-(2-morpholin-4-yl-2-phenylethyl)furan-2-carboxamide has a molecular weight of 334.80 g/mol, XLogP of 2.74, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(2-morpholin-4-yl-2-phenylethyl)furan-2-carboxamide is sourced from PubChem (CID 86922955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).