2-(2-cyanophenoxy)-N-[(2R)-3-methyl-2-morpholin-4-ylbutyl]acetamide

C18H25N3O3 — CID 30901944

IUPAC2-(2-cyanophenoxy)-N-[(2R)-3-methyl-2-morpholin-4-ylbutyl]acetamide
SMILESCC(C)[C@H](CNC(=O)COc1ccccc1C#N)N1CCOCC1
InChIInChI=1S/C18H25N3O3/c1-14(2)16(21-7-9-23-10-8-21)12-20-18(22)13-24-17-6-4-3-5-15(17)11-19/h3-6,14,16H,7-10,12-13H2,1-2H3,(H,20,22)/t16-/m0/s1
InChIKeyFDPCFSCLBVOIMI-INIZCTEOSA-N
MW331.42 g/mol
LogP1.41
Rot. Bonds7

About 2-(2-cyanophenoxy)-N-[(2R)-3-methyl-2-morpholin-4-ylbutyl]acetamide

2-(2-cyanophenoxy)-N-[(2R)-3-methyl-2-morpholin-4-ylbutyl]acetamide (PubChem CID 30901944) has the molecular formula C18H25N3O3 and a molecular weight of 331.42 g/mol. Its IUPAC name is 2-(2-cyanophenoxy)-N-[(2R)-3-methyl-2-morpholin-4-ylbutyl]acetamide.

Molecular Properties

Compound Name2-(2-cyanophenoxy)-N-[(2R)-3-methyl-2-morpholin-4-ylbutyl]acetamide
PubChem CID30901944
Molecular FormulaC18H25N3O3
Molecular Weight331.42 g/mol
Exact Mass331.19
IUPAC Name2-(2-cyanophenoxy)-N-[(2R)-3-methyl-2-morpholin-4-ylbutyl]acetamide
SMILESCC(C)[C@H](CNC(=O)COc1ccccc1C#N)N1CCOCC1
InChIInChI=1S/C18H25N3O3/c1-14(2)16(21-7-9-23-10-8-21)12-20-18(22)13-24-17-6-4-3-5-15(17)11-19/h3-6,14,16H,7-10,12-13H2,1-2H3,(H,20,22)/t16-/m0/s1
InChIKeyFDPCFSCLBVOIMI-INIZCTEOSA-N
XLogP1.41
TPSA74.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.42
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2,4-dimethylphenoxy)-N-(3-methyl-2-morpholin-4-ylbutyl)acetamide
CID 43067301
2-(2-cyanophenoxy)-N-(2-methylsulfinylpropyl)acetamide
CID 115764495
2-(4-bromophenoxy)-N-(3-methyl-2-morpholin-4-ylbutyl)acetamide
CID 18153802
2-(2-cyanophenoxy)-N-(3-methoxy-2-methylpropyl)acetamide
CID 48685478
2-(2-cyanophenoxy)-N-(2-methyl-3-methylsulfanylpropyl)acetamide
CID 63959775
2-(2-cyanophenoxy)-N-[(2R)-3-methylbutan-2-yl]acetamide
CID 2706739
2-(2-cyanophenoxy)-N-[(1R)-2-morpholin-4-yl-1-phenylethyl]acetamide
CID 9148844
N-(2-aminoethyl)-2-(2-cyanophenoxy)acetamide
CID 12841749
N-[(2S)-3-methyl-2-morpholin-4-ylbutyl]-3-thiophen-2-ylpropanamide
CID 94249164
2-(2-cyanophenoxy)-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]acetamide
CID 9142639
2-methyl-N-(3-methyl-2-morpholin-4-ylbutyl)benzamide
CID 110402733
N-(3-methyl-2-morpholin-4-ylbutyl)-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide
CID 55520450

Frequently Asked Questions

What is the IUPAC name of 2-(2-cyanophenoxy)-N-[(2R)-3-methyl-2-morpholin-4-ylbutyl]acetamide?
The IUPAC name of 2-(2-cyanophenoxy)-N-[(2R)-3-methyl-2-morpholin-4-ylbutyl]acetamide (CID 30901944) is 2-(2-cyanophenoxy)-N-[(2R)-3-methyl-2-morpholin-4-ylbutyl]acetamide.
What is the SMILES notation for 2-(2-cyanophenoxy)-N-[(2R)-3-methyl-2-morpholin-4-ylbutyl]acetamide?
The canonical SMILES for 2-(2-cyanophenoxy)-N-[(2R)-3-methyl-2-morpholin-4-ylbutyl]acetamide is CC(C)[C@H](CNC(=O)COc1ccccc1C#N)N1CCOCC1.
What is the InChIKey of 2-(2-cyanophenoxy)-N-[(2R)-3-methyl-2-morpholin-4-ylbutyl]acetamide?
The InChIKey is FDPCFSCLBVOIMI-INIZCTEOSA-N. The full InChI is InChI=1S/C18H25N3O3/c1-14(2)16(21-7-9-23-10-8-21)12-20-18(22)13-24-17-6-4-3-5-15(17)11-19/h3-6,14,16H,7-10,12-13H2,1-2H3,(H,20,22)/t16-/m0/s1.
What are the key properties of 2-(2-cyanophenoxy)-N-[(2R)-3-methyl-2-morpholin-4-ylbutyl]acetamide?
2-(2-cyanophenoxy)-N-[(2R)-3-methyl-2-morpholin-4-ylbutyl]acetamide has a molecular weight of 331.42 g/mol, XLogP of 1.41, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyanophenoxy)-N-[(2R)-3-methyl-2-morpholin-4-ylbutyl]acetamide is sourced from PubChem (CID 30901944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).