3-(4-chlorophenyl)-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-2-methylpropanamide

C20H25ClN2O3 — CID 110302218

IUPAC3-(4-chlorophenyl)-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-2-methylpropanamide
SMILESCC(Cc1ccc(Cl)cc1)C(=O)NCC(c1ccco1)N1CCOCC1
InChIInChI=1S/C20H25ClN2O3/c1-15(13-16-4-6-17(21)7-5-16)20(24)22-14-18(19-3-2-10-26-19)23-8-11-25-12-9-23/h2-7,10,15,18H,8-9,11-14H2,1H3,(H,22,24)
InChIKeyPNQQTGDYISCGER-UHFFFAOYSA-N
MW376.88 g/mol
LogP3.30
Rot. Bonds7

About 3-(4-chlorophenyl)-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-2-methylpropanamide

3-(4-chlorophenyl)-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-2-methylpropanamide (PubChem CID 110302218) has the molecular formula C20H25ClN2O3 and a molecular weight of 376.88 g/mol. Its IUPAC name is 3-(4-chlorophenyl)-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-2-methylpropanamide.

Molecular Properties

Compound Name3-(4-chlorophenyl)-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-2-methylpropanamide
PubChem CID110302218
Molecular FormulaC20H25ClN2O3
Molecular Weight376.88 g/mol
Exact Mass376.16
IUPAC Name3-(4-chlorophenyl)-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-2-methylpropanamide
SMILESCC(Cc1ccc(Cl)cc1)C(=O)NCC(c1ccco1)N1CCOCC1
InChIInChI=1S/C20H25ClN2O3/c1-15(13-16-4-6-17(21)7-5-16)20(24)22-14-18(19-3-2-10-26-19)23-8-11-25-12-9-23/h2-7,10,15,18H,8-9,11-14H2,1H3,(H,22,24)
InChIKeyPNQQTGDYISCGER-UHFFFAOYSA-N
XLogP3.30
TPSA54.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.88
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(4-chlorophenyl)-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]butanamide
CID 110302200
N-[2-(4-chlorophenyl)-2-morpholin-4-ylethyl]-2-methyl-3-(methylamino)propanamide;dihydrochloride
CID 119867154
(2R)-2-(4-chlorophenyl)sulfanyl-N-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]propanamide
CID 40744935
3-chloro-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]benzamide
CID 16809743
N-[(2S)-2-(furan-2-yl)-2-morpholin-4-ylethyl]butanamide
CID 26819488
ethyl N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]carbamate
CID 112502966
(2R)-2-amino-N-[2-(4-chlorophenyl)-2-morpholin-4-ylethyl]propanamide
CID 119867147
1-[(4-chlorophenyl)methyl]-3-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]urea
CID 36872492
N-[(2-chlorophenyl)methyl]-N'-[(2R)-2-(furan-2-yl)-2-morpholin-4-ylethyl]oxamide
CID 7217373
N-[(2-chlorophenyl)methyl]-N'-[(2S)-2-(furan-2-yl)-2-morpholin-4-ylethyl]oxamide
CID 7217371
(2R)-2-(4-fluorophenoxy)-N-[(2S)-2-(furan-2-yl)-2-morpholin-4-ylethyl]propanamide
CID 35128117
2-amino-N-[2-(4-chlorophenyl)-2-morpholin-4-ylethyl]-3-phenylpropanamide;dihydrochloride
CID 119867130

Frequently Asked Questions

What is the IUPAC name of 3-(4-chlorophenyl)-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-2-methylpropanamide?
The IUPAC name of 3-(4-chlorophenyl)-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-2-methylpropanamide (CID 110302218) is 3-(4-chlorophenyl)-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-2-methylpropanamide.
What is the SMILES notation for 3-(4-chlorophenyl)-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-2-methylpropanamide?
The canonical SMILES for 3-(4-chlorophenyl)-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-2-methylpropanamide is CC(Cc1ccc(Cl)cc1)C(=O)NCC(c1ccco1)N1CCOCC1.
What is the InChIKey of 3-(4-chlorophenyl)-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-2-methylpropanamide?
The InChIKey is PNQQTGDYISCGER-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25ClN2O3/c1-15(13-16-4-6-17(21)7-5-16)20(24)22-14-18(19-3-2-10-26-19)23-8-11-25-12-9-23/h2-7,10,15,18H,8-9,11-14H2,1H3,(H,22,24).
What are the key properties of 3-(4-chlorophenyl)-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-2-methylpropanamide?
3-(4-chlorophenyl)-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-2-methylpropanamide has a molecular weight of 376.88 g/mol, XLogP of 3.30, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-chlorophenyl)-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-2-methylpropanamide is sourced from PubChem (CID 110302218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).