N-[(2R)-2-(furan-2-yl)-2-(4-propan-2-ylphenyl)sulfonylethyl]pentanamide

C20H27NO4S — CID 9161490

IUPACN-[(2R)-2-(furan-2-yl)-2-(4-propan-2-ylphenyl)sulfonylethyl]pentanamide
SMILESCCCCC(=O)NC[C@H](c1ccco1)S(=O)(=O)c1ccc(C(C)C)cc1
InChIInChI=1S/C20H27NO4S/c1-4-5-8-20(22)21-14-19(18-7-6-13-25-18)26(23,24)17-11-9-16(10-12-17)15(2)3/h6-7,9-13,15,19H,4-5,8,14H2,1-3H3,(H,21,22)/t19-/m1/s1
InChIKeyDRJSWRRBZZYVEZ-LJQANCHMSA-N
MW377.51 g/mol
LogP4.22
Rot. Bonds9

About N-[(2R)-2-(furan-2-yl)-2-(4-propan-2-ylphenyl)sulfonylethyl]pentanamide

N-[(2R)-2-(furan-2-yl)-2-(4-propan-2-ylphenyl)sulfonylethyl]pentanamide (PubChem CID 9161490) has the molecular formula C20H27NO4S and a molecular weight of 377.51 g/mol. Its IUPAC name is N-[(2R)-2-(furan-2-yl)-2-(4-propan-2-ylphenyl)sulfonylethyl]pentanamide.

Molecular Properties

Compound NameN-[(2R)-2-(furan-2-yl)-2-(4-propan-2-ylphenyl)sulfonylethyl]pentanamide
PubChem CID9161490
Molecular FormulaC20H27NO4S
Molecular Weight377.51 g/mol
Exact Mass377.17
IUPAC NameN-[(2R)-2-(furan-2-yl)-2-(4-propan-2-ylphenyl)sulfonylethyl]pentanamide
SMILESCCCCC(=O)NC[C@H](c1ccco1)S(=O)(=O)c1ccc(C(C)C)cc1
InChIInChI=1S/C20H27NO4S/c1-4-5-8-20(22)21-14-19(18-7-6-13-25-18)26(23,24)17-11-9-16(10-12-17)15(2)3/h6-7,9-13,15,19H,4-5,8,14H2,1-3H3,(H,21,22)/t19-/m1/s1
InChIKeyDRJSWRRBZZYVEZ-LJQANCHMSA-N
XLogP4.22
TPSA76.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.51
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-chloro-N-[(2S)-2-(furan-2-yl)-2-(4-propan-2-ylphenyl)sulfonylethyl]acetamide
CID 9161526
1-[(2R)-2-(furan-2-yl)-2-(4-propan-2-ylphenyl)sulfonylethyl]-3-propylurea
CID 9161691
N-[(2R)-2-(furan-2-yl)-2-(4-propan-2-ylphenyl)sulfonylethyl]propane-1-sulfonamide
CID 9161431
N'-cyclopropyl-N-[(2S)-2-(furan-2-yl)-2-(4-propan-2-ylphenyl)sulfonylethyl]oxamide
CID 9161752
N'-cyclopropyl-N-[(2R)-2-(furan-2-yl)-2-(4-propan-2-ylphenyl)sulfonylethyl]oxamide
CID 9161759
N-[(2S)-2-(furan-2-yl)-2-(4-propan-2-ylphenyl)sulfonylethyl]-3,4-dimethylbenzamide
CID 9161587
N-[(2S)-2-(furan-2-yl)-2-(4-methylphenyl)sulfonylethyl]-2-methylpropanamide
CID 7268134
N-[(2R)-2-(furan-2-yl)-2-thiophen-2-ylsulfonylethyl]butanamide
CID 7268311
N-[(2S)-2-(4-chlorophenyl)sulfonyl-2-(furan-2-yl)ethyl]-2,2-dimethylpropanamide
CID 7268165
4-chloro-N-[2-(4-chlorophenyl)sulfonyl-2-(furan-2-yl)ethyl]benzamide
CID 22584561
N'-[2-(benzenesulfonyl)-2-(furan-2-yl)ethyl]-N-(3-methylbutyl)oxamide
CID 22584425
N'-[(2R)-2-(4-fluorophenyl)sulfonyl-2-(furan-2-yl)ethyl]-N-(3-methylbutyl)oxamide
CID 7268216

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-(furan-2-yl)-2-(4-propan-2-ylphenyl)sulfonylethyl]pentanamide?
The IUPAC name of N-[(2R)-2-(furan-2-yl)-2-(4-propan-2-ylphenyl)sulfonylethyl]pentanamide (CID 9161490) is N-[(2R)-2-(furan-2-yl)-2-(4-propan-2-ylphenyl)sulfonylethyl]pentanamide.
What is the SMILES notation for N-[(2R)-2-(furan-2-yl)-2-(4-propan-2-ylphenyl)sulfonylethyl]pentanamide?
The canonical SMILES for N-[(2R)-2-(furan-2-yl)-2-(4-propan-2-ylphenyl)sulfonylethyl]pentanamide is CCCCC(=O)NC[C@H](c1ccco1)S(=O)(=O)c1ccc(C(C)C)cc1.
What is the InChIKey of N-[(2R)-2-(furan-2-yl)-2-(4-propan-2-ylphenyl)sulfonylethyl]pentanamide?
The InChIKey is DRJSWRRBZZYVEZ-LJQANCHMSA-N. The full InChI is InChI=1S/C20H27NO4S/c1-4-5-8-20(22)21-14-19(18-7-6-13-25-18)26(23,24)17-11-9-16(10-12-17)15(2)3/h6-7,9-13,15,19H,4-5,8,14H2,1-3H3,(H,21,22)/t19-/m1/s1.
What are the key properties of N-[(2R)-2-(furan-2-yl)-2-(4-propan-2-ylphenyl)sulfonylethyl]pentanamide?
N-[(2R)-2-(furan-2-yl)-2-(4-propan-2-ylphenyl)sulfonylethyl]pentanamide has a molecular weight of 377.51 g/mol, XLogP of 4.22, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-(furan-2-yl)-2-(4-propan-2-ylphenyl)sulfonylethyl]pentanamide is sourced from PubChem (CID 9161490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).