5-(phenoxymethyl)-N-[(1R)-1-thiophen-2-ylethyl]furan-2-carboxamide

C18H17NO3S — CID 33465538

IUPAC5-(phenoxymethyl)-N-[(1R)-1-thiophen-2-ylethyl]furan-2-carboxamide
SMILESC[C@@H](NC(=O)c1ccc(COc2ccccc2)o1)c1cccs1
InChIInChI=1S/C18H17NO3S/c1-13(17-8-5-11-23-17)19-18(20)16-10-9-15(22-16)12-21-14-6-3-2-4-7-14/h2-11,13H,12H2,1H3,(H,19,20)/t13-/m1/s1
InChIKeyCFSGEXJZLNCYMA-CYBMUJFWSA-N
MW327.41 g/mol
LogP4.41
Rot. Bonds6

About 5-(phenoxymethyl)-N-[(1R)-1-thiophen-2-ylethyl]furan-2-carboxamide

5-(phenoxymethyl)-N-[(1R)-1-thiophen-2-ylethyl]furan-2-carboxamide (PubChem CID 33465538) has the molecular formula C18H17NO3S and a molecular weight of 327.41 g/mol. Its IUPAC name is 5-(phenoxymethyl)-N-[(1R)-1-thiophen-2-ylethyl]furan-2-carboxamide.

Molecular Properties

Compound Name5-(phenoxymethyl)-N-[(1R)-1-thiophen-2-ylethyl]furan-2-carboxamide
PubChem CID33465538
Molecular FormulaC18H17NO3S
Molecular Weight327.41 g/mol
Exact Mass327.09
IUPAC Name5-(phenoxymethyl)-N-[(1R)-1-thiophen-2-ylethyl]furan-2-carboxamide
SMILESC[C@@H](NC(=O)c1ccc(COc2ccccc2)o1)c1cccs1
InChIInChI=1S/C18H17NO3S/c1-13(17-8-5-11-23-17)19-18(20)16-10-9-15(22-16)12-21-14-6-3-2-4-7-14/h2-11,13H,12H2,1H3,(H,19,20)/t13-/m1/s1
InChIKeyCFSGEXJZLNCYMA-CYBMUJFWSA-N
XLogP4.41
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.41
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-5-(phenoxymethyl)furan-2-carboxamide
CID 7678218
5-[(3-methylphenoxy)methyl]-N-(1-phenylethyl)furan-2-carboxamide
CID 19465616
N-[1-(3,4-diethoxyphenyl)ethyl]-5-(phenoxymethyl)furan-2-carboxamide
CID 43011698
3-phenoxy-N-(1-thiophen-2-ylethyl)propanamide
CID 110733991
5-(phenoxymethyl)-N'-(4-thiophen-2-ylbutanoyl)furan-2-carbohydrazide
CID 9219783
N-(3-methylbutan-2-yl)-5-[(4-methylphenoxy)methyl]furan-2-carboxamide
CID 43048903
N-[(1S)-1-thiophen-2-ylethyl]benzamide
CID 768439
2-[[5-(phenoxymethyl)furan-2-carbonyl]amino]acetic acid
CID 82043257
N'-(2-methoxyacetyl)-5-(phenoxymethyl)furan-2-carbohydrazide
CID 31466053
phenyl N-(1-thiophen-2-ylethyl)carbamate
CID 60629917
(2R)-2-[[5-[(4-bromophenoxy)methyl]furan-2-carbonyl]amino]-3-methylbutanoic acid
CID 119369410
5-[(2-methoxyphenoxy)methyl]-N-[(1S)-1-(4-methoxyphenyl)ethyl]furan-2-carboxamide
CID 35529733

Frequently Asked Questions

What is the IUPAC name of 5-(phenoxymethyl)-N-[(1R)-1-thiophen-2-ylethyl]furan-2-carboxamide?
The IUPAC name of 5-(phenoxymethyl)-N-[(1R)-1-thiophen-2-ylethyl]furan-2-carboxamide (CID 33465538) is 5-(phenoxymethyl)-N-[(1R)-1-thiophen-2-ylethyl]furan-2-carboxamide.
What is the SMILES notation for 5-(phenoxymethyl)-N-[(1R)-1-thiophen-2-ylethyl]furan-2-carboxamide?
The canonical SMILES for 5-(phenoxymethyl)-N-[(1R)-1-thiophen-2-ylethyl]furan-2-carboxamide is C[C@@H](NC(=O)c1ccc(COc2ccccc2)o1)c1cccs1.
What is the InChIKey of 5-(phenoxymethyl)-N-[(1R)-1-thiophen-2-ylethyl]furan-2-carboxamide?
The InChIKey is CFSGEXJZLNCYMA-CYBMUJFWSA-N. The full InChI is InChI=1S/C18H17NO3S/c1-13(17-8-5-11-23-17)19-18(20)16-10-9-15(22-16)12-21-14-6-3-2-4-7-14/h2-11,13H,12H2,1H3,(H,19,20)/t13-/m1/s1.
What are the key properties of 5-(phenoxymethyl)-N-[(1R)-1-thiophen-2-ylethyl]furan-2-carboxamide?
5-(phenoxymethyl)-N-[(1R)-1-thiophen-2-ylethyl]furan-2-carboxamide has a molecular weight of 327.41 g/mol, XLogP of 4.41, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(phenoxymethyl)-N-[(1R)-1-thiophen-2-ylethyl]furan-2-carboxamide is sourced from PubChem (CID 33465538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).