N-[(2R)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(4-pyridin-2-yloxyphenoxy)acetamide

C21H23N3O4 — CID 30901572

IUPACN-[(2R)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(4-pyridin-2-yloxyphenoxy)acetamide
SMILESCN(C)[C@H](CNC(=O)COc1ccc(Oc2ccccn2)cc1)c1ccco1
InChIInChI=1S/C21H23N3O4/c1-24(2)18(19-6-5-13-26-19)14-23-20(25)15-27-16-8-10-17(11-9-16)28-21-7-3-4-12-22-21/h3-13,18H,14-15H2,1-2H3,(H,23,25)/t18-/m1/s1
InChIKeyNPUGHROKJMIIPE-GOSISDBHSA-N
MW381.43 g/mol
LogP3.26
Rot. Bonds9

About N-[(2R)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(4-pyridin-2-yloxyphenoxy)acetamide

N-[(2R)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(4-pyridin-2-yloxyphenoxy)acetamide (PubChem CID 30901572) has the molecular formula C21H23N3O4 and a molecular weight of 381.43 g/mol. Its IUPAC name is N-[(2R)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(4-pyridin-2-yloxyphenoxy)acetamide.

Molecular Properties

Compound NameN-[(2R)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(4-pyridin-2-yloxyphenoxy)acetamide
PubChem CID30901572
Molecular FormulaC21H23N3O4
Molecular Weight381.43 g/mol
Exact Mass381.17
IUPAC NameN-[(2R)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(4-pyridin-2-yloxyphenoxy)acetamide
SMILESCN(C)[C@H](CNC(=O)COc1ccc(Oc2ccccn2)cc1)c1ccco1
InChIInChI=1S/C21H23N3O4/c1-24(2)18(19-6-5-13-26-19)14-23-20(25)15-27-16-8-10-17(11-9-16)28-21-7-3-4-12-22-21/h3-13,18H,14-15H2,1-2H3,(H,23,25)/t18-/m1/s1
InChIKeyNPUGHROKJMIIPE-GOSISDBHSA-N
XLogP3.26
TPSA76.83 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.43
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[(2R)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(4-ethylphenoxy)acetamide
CID 26819096
N-[(2R)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(3,5-dimethylphenoxy)acetamide
CID 26819079
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(2-methylphenoxy)acetamide
CID 19114396
N-[(2S)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(2-methylphenoxy)acetamide
CID 26819035
N-[(2R)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(3-methylphenoxy)acetamide
CID 26819049
N-propyl-2-(4-pyridin-2-yloxyphenoxy)acetamide
CID 36805335
N-[(2S)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-ethoxyacetamide
CID 95236001
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(2,4,6-trimethylphenoxy)acetamide
CID 19114412
2-[2-[[2-(dimethylamino)-2-(furan-2-yl)ethyl]amino]-2-oxoethoxy]acetic acid
CID 60662226
N-[(5-methylthiophen-2-yl)methyl]-2-(4-pyridin-2-yloxyphenoxy)acetamide
CID 87004197
N-[(2-methyl-1,3-thiazol-5-yl)methyl]-2-(4-pyridin-2-yloxyphenoxy)acetamide
CID 86836191
N-[(6-methyl-2-pyridinyl)methyl]-2-(4-pyridin-2-yloxyphenoxy)acetamide
CID 87041581

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(4-pyridin-2-yloxyphenoxy)acetamide?
The IUPAC name of N-[(2R)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(4-pyridin-2-yloxyphenoxy)acetamide (CID 30901572) is N-[(2R)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(4-pyridin-2-yloxyphenoxy)acetamide.
What is the SMILES notation for N-[(2R)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(4-pyridin-2-yloxyphenoxy)acetamide?
The canonical SMILES for N-[(2R)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(4-pyridin-2-yloxyphenoxy)acetamide is CN(C)[C@H](CNC(=O)COc1ccc(Oc2ccccn2)cc1)c1ccco1.
What is the InChIKey of N-[(2R)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(4-pyridin-2-yloxyphenoxy)acetamide?
The InChIKey is NPUGHROKJMIIPE-GOSISDBHSA-N. The full InChI is InChI=1S/C21H23N3O4/c1-24(2)18(19-6-5-13-26-19)14-23-20(25)15-27-16-8-10-17(11-9-16)28-21-7-3-4-12-22-21/h3-13,18H,14-15H2,1-2H3,(H,23,25)/t18-/m1/s1.
What are the key properties of N-[(2R)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(4-pyridin-2-yloxyphenoxy)acetamide?
N-[(2R)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(4-pyridin-2-yloxyphenoxy)acetamide has a molecular weight of 381.43 g/mol, XLogP of 3.26, 9 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(4-pyridin-2-yloxyphenoxy)acetamide is sourced from PubChem (CID 30901572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).