2-(4-cyanophenoxy)-N-[(1-phenylcyclobutyl)methyl]acetamide

C20H20N2O2 — CID 17437937

IUPAC2-(4-cyanophenoxy)-N-[(1-phenylcyclobutyl)methyl]acetamide
SMILESN#Cc1ccc(OCC(=O)NCC2(c3ccccc3)CCC2)cc1
InChIInChI=1S/C20H20N2O2/c21-13-16-7-9-18(10-8-16)24-14-19(23)22-15-20(11-4-12-20)17-5-2-1-3-6-17/h1-3,5-10H,4,11-12,14-15H2,(H,22,23)
InChIKeyJJFKFMMKKZZWKQ-UHFFFAOYSA-N
MW320.39 g/mol
LogP3.18
Rot. Bonds6

About 2-(4-cyanophenoxy)-N-[(1-phenylcyclobutyl)methyl]acetamide

2-(4-cyanophenoxy)-N-[(1-phenylcyclobutyl)methyl]acetamide (PubChem CID 17437937) has the molecular formula C20H20N2O2 and a molecular weight of 320.39 g/mol. Its IUPAC name is 2-(4-cyanophenoxy)-N-[(1-phenylcyclobutyl)methyl]acetamide.

Molecular Properties

Compound Name2-(4-cyanophenoxy)-N-[(1-phenylcyclobutyl)methyl]acetamide
PubChem CID17437937
Molecular FormulaC20H20N2O2
Molecular Weight320.39 g/mol
Exact Mass320.15
IUPAC Name2-(4-cyanophenoxy)-N-[(1-phenylcyclobutyl)methyl]acetamide
SMILESN#Cc1ccc(OCC(=O)NCC2(c3ccccc3)CCC2)cc1
InChIInChI=1S/C20H20N2O2/c21-13-16-7-9-18(10-8-16)24-14-19(23)22-15-20(11-4-12-20)17-5-2-1-3-6-17/h1-3,5-10H,4,11-12,14-15H2,(H,22,23)
InChIKeyJJFKFMMKKZZWKQ-UHFFFAOYSA-N
XLogP3.18
TPSA62.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.39
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 4-[2-oxo-2-[(1-phenylcyclopropyl)methylamino]ethoxy]benzoate
CID 134038073
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CID 55759227
2-(1,3-benzodioxol-5-yloxy)-N-[(1-phenylcyclopentyl)methyl]acetamide
CID 171132856
2-[4-(5-oxo-4H-1,2,4-oxadiazol-3-yl)phenoxy]-N-[(1-phenylcyclohexyl)methyl]acetamide
CID 166355790
2-[4-(4-cyanophenyl)-1,4-diazepan-1-yl]-N-[(1-phenylcyclobutyl)methyl]acetamide
CID 55827578
2-(2-methoxyphenoxy)-N-[(1-phenylcyclopentyl)methyl]acetamide
CID 18128274
2-(4-cyanophenoxy)-N-[(1-piperidin-1-ylcyclohexyl)methyl]acetamide
CID 2426774
2-[4-(4-fluorobenzoyl)phenoxy]-N-[(4-phenyloxan-4-yl)methyl]acetamide
CID 55849523
3-amino-N-[(1-phenylcyclobutyl)methyl]propanamide
CID 110460227
2-[(5-cyano-2-pyridinyl)-methylamino]-N-[(1-phenylcyclopropyl)methyl]acetamide
CID 56818310
2-(4-cyanophenoxy)-N-(2-phenylpropyl)acetamide
CID 16540648
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CID 60573373

Frequently Asked Questions

What is the IUPAC name of 2-(4-cyanophenoxy)-N-[(1-phenylcyclobutyl)methyl]acetamide?
The IUPAC name of 2-(4-cyanophenoxy)-N-[(1-phenylcyclobutyl)methyl]acetamide (CID 17437937) is 2-(4-cyanophenoxy)-N-[(1-phenylcyclobutyl)methyl]acetamide.
What is the SMILES notation for 2-(4-cyanophenoxy)-N-[(1-phenylcyclobutyl)methyl]acetamide?
The canonical SMILES for 2-(4-cyanophenoxy)-N-[(1-phenylcyclobutyl)methyl]acetamide is N#Cc1ccc(OCC(=O)NCC2(c3ccccc3)CCC2)cc1.
What is the InChIKey of 2-(4-cyanophenoxy)-N-[(1-phenylcyclobutyl)methyl]acetamide?
The InChIKey is JJFKFMMKKZZWKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O2/c21-13-16-7-9-18(10-8-16)24-14-19(23)22-15-20(11-4-12-20)17-5-2-1-3-6-17/h1-3,5-10H,4,11-12,14-15H2,(H,22,23).
What are the key properties of 2-(4-cyanophenoxy)-N-[(1-phenylcyclobutyl)methyl]acetamide?
2-(4-cyanophenoxy)-N-[(1-phenylcyclobutyl)methyl]acetamide has a molecular weight of 320.39 g/mol, XLogP of 3.18, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-cyanophenoxy)-N-[(1-phenylcyclobutyl)methyl]acetamide is sourced from PubChem (CID 17437937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).