N-[3-[1-[2-(2-methyl-2-propylcyclopropyl)naphthalen-1-yl]naphthalen-2-yl]oxyphenyl]acetamide

C35H33NO2 — CID 144667134

IUPACN-[3-[1-[2-(2-methyl-2-propylcyclopropyl)naphthalen-1-yl]naphthalen-2-yl]oxyphenyl]acetamide
SMILESCCCC1(C)CC1c1ccc2ccccc2c1-c1c(Oc2cccc(NC(C)=O)c2)ccc2ccccc12
InChIInChI=1S/C35H33NO2/c1-4-20-35(3)22-31(35)30-18-16-24-10-5-7-14-28(24)33(30)34-29-15-8-6-11-25(29)17-19-32(34)38-27-13-9-12-26(21-27)36-23(2)37/h5-19,21,31H,4,20,22H2,1-3H3,(H,36,37)
InChIKeyNAOWAHPSORAMJO-UHFFFAOYSA-N
MW499.65 g/mol
LogP9.70
Rot. Bonds7

About N-[3-[1-[2-(2-methyl-2-propylcyclopropyl)naphthalen-1-yl]naphthalen-2-yl]oxyphenyl]acetamide

N-[3-[1-[2-(2-methyl-2-propylcyclopropyl)naphthalen-1-yl]naphthalen-2-yl]oxyphenyl]acetamide (PubChem CID 144667134) has the molecular formula C35H33NO2 and a molecular weight of 499.65 g/mol. Its IUPAC name is N-[3-[1-[2-(2-methyl-2-propylcyclopropyl)naphthalen-1-yl]naphthalen-2-yl]oxyphenyl]acetamide.

Molecular Properties

Compound NameN-[3-[1-[2-(2-methyl-2-propylcyclopropyl)naphthalen-1-yl]naphthalen-2-yl]oxyphenyl]acetamide
PubChem CID144667134
Molecular FormulaC35H33NO2
Molecular Weight499.65 g/mol
Exact Mass499.25
IUPAC NameN-[3-[1-[2-(2-methyl-2-propylcyclopropyl)naphthalen-1-yl]naphthalen-2-yl]oxyphenyl]acetamide
SMILESCCCC1(C)CC1c1ccc2ccccc2c1-c1c(Oc2cccc(NC(C)=O)c2)ccc2ccccc12
InChIInChI=1S/C35H33NO2/c1-4-20-35(3)22-31(35)30-18-16-24-10-5-7-14-28(24)33(30)34-29-15-8-6-11-25(29)17-19-32(34)38-27-13-9-12-26(21-27)36-23(2)37/h5-19,21,31H,4,20,22H2,1-3H3,(H,36,37)
InChIKeyNAOWAHPSORAMJO-UHFFFAOYSA-N
XLogP9.70
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms38
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500499.65
LogP ≤ 59.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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methane;N-(3-methoxyphenyl)acetamide
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CID 22660295
N-[3-(2-amino-4-chlorophenoxy)phenyl]acetamide
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CID 92671782
N-[3-(1-propylbenzo[e][1,2]benzoxazol-7-yl)oxyphenyl]acetamide
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N-[3-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]acetamide
CID 54359484
naphthalen-2-yl 2-(3-acetamidophenoxy)acetate
CID 18870014
N-[3-[(E)-3-[2-(difluoromethoxy)naphthalen-1-yl]prop-2-enoyl]phenyl]acetamide
CID 8858867
[1-(2-butanoyloxynaphthalen-1-yl)naphthalen-2-yl] butanoate
CID 11004443

Frequently Asked Questions

What is the IUPAC name of N-[3-[1-[2-(2-methyl-2-propylcyclopropyl)naphthalen-1-yl]naphthalen-2-yl]oxyphenyl]acetamide?
The IUPAC name of N-[3-[1-[2-(2-methyl-2-propylcyclopropyl)naphthalen-1-yl]naphthalen-2-yl]oxyphenyl]acetamide (CID 144667134) is N-[3-[1-[2-(2-methyl-2-propylcyclopropyl)naphthalen-1-yl]naphthalen-2-yl]oxyphenyl]acetamide.
What is the SMILES notation for N-[3-[1-[2-(2-methyl-2-propylcyclopropyl)naphthalen-1-yl]naphthalen-2-yl]oxyphenyl]acetamide?
The canonical SMILES for N-[3-[1-[2-(2-methyl-2-propylcyclopropyl)naphthalen-1-yl]naphthalen-2-yl]oxyphenyl]acetamide is CCCC1(C)CC1c1ccc2ccccc2c1-c1c(Oc2cccc(NC(C)=O)c2)ccc2ccccc12.
What is the InChIKey of N-[3-[1-[2-(2-methyl-2-propylcyclopropyl)naphthalen-1-yl]naphthalen-2-yl]oxyphenyl]acetamide?
The InChIKey is NAOWAHPSORAMJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H33NO2/c1-4-20-35(3)22-31(35)30-18-16-24-10-5-7-14-28(24)33(30)34-29-15-8-6-11-25(29)17-19-32(34)38-27-13-9-12-26(21-27)36-23(2)37/h5-19,21,31H,4,20,22H2,1-3H3,(H,36,37).
What are the key properties of N-[3-[1-[2-(2-methyl-2-propylcyclopropyl)naphthalen-1-yl]naphthalen-2-yl]oxyphenyl]acetamide?
N-[3-[1-[2-(2-methyl-2-propylcyclopropyl)naphthalen-1-yl]naphthalen-2-yl]oxyphenyl]acetamide has a molecular weight of 499.65 g/mol, XLogP of 9.70, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[1-[2-(2-methyl-2-propylcyclopropyl)naphthalen-1-yl]naphthalen-2-yl]oxyphenyl]acetamide is sourced from PubChem (CID 144667134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).