N-[4-(2-methylpropoxy)naphthalen-1-yl]-1-phenylcyclopentane-1-carboxamide

C26H29NO2 — CID 100719168

IUPACN-[4-(2-methylpropoxy)naphthalen-1-yl]-1-phenylcyclopentane-1-carboxamide
SMILESCC(C)COc1ccc(NC(=O)C2(c3ccccc3)CCCC2)c2ccccc12
InChIInChI=1S/C26H29NO2/c1-19(2)18-29-24-15-14-23(21-12-6-7-13-22(21)24)27-25(28)26(16-8-9-17-26)20-10-4-3-5-11-20/h3-7,10-15,19H,8-9,16-18H2,1-2H3,(H,27,28)
InChIKeyNKWUYBGNUJELSD-UHFFFAOYSA-N
MW387.52 g/mol
LogP6.33
Rot. Bonds6

About N-[4-(2-methylpropoxy)naphthalen-1-yl]-1-phenylcyclopentane-1-carboxamide

N-[4-(2-methylpropoxy)naphthalen-1-yl]-1-phenylcyclopentane-1-carboxamide (PubChem CID 100719168) has the molecular formula C26H29NO2 and a molecular weight of 387.52 g/mol. Its IUPAC name is N-[4-(2-methylpropoxy)naphthalen-1-yl]-1-phenylcyclopentane-1-carboxamide.

Molecular Properties

Compound NameN-[4-(2-methylpropoxy)naphthalen-1-yl]-1-phenylcyclopentane-1-carboxamide
PubChem CID100719168
Molecular FormulaC26H29NO2
Molecular Weight387.52 g/mol
Exact Mass387.22
IUPAC NameN-[4-(2-methylpropoxy)naphthalen-1-yl]-1-phenylcyclopentane-1-carboxamide
SMILESCC(C)COc1ccc(NC(=O)C2(c3ccccc3)CCCC2)c2ccccc12
InChIInChI=1S/C26H29NO2/c1-19(2)18-29-24-15-14-23(21-12-6-7-13-22(21)24)27-25(28)26(16-8-9-17-26)20-10-4-3-5-11-20/h3-7,10-15,19H,8-9,16-18H2,1-2H3,(H,27,28)
InChIKeyNKWUYBGNUJELSD-UHFFFAOYSA-N
XLogP6.33
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500387.52
LogP ≤ 56.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-methoxyphenyl)-N-[4-(2-methylpropoxy)naphthalen-1-yl]cyclohexane-1-carboxamide
CID 100747706
1-(4-chlorophenyl)-N-[4-(2-methylpropoxy)naphthalen-1-yl]cyclopropane-1-carboxamide
CID 100782430
1-(1,3-benzodioxol-5-yl)-N-[4-(2-methylpropoxy)naphthalen-1-yl]cyclopentane-1-carboxamide
CID 100782956
1-(4-methylphenyl)-N-[8-(2-methylpropoxy)quinolin-5-yl]cyclohexane-1-carboxamide
CID 100770996
N-(4-methoxynaphthalen-1-yl)-1-phenylcyclopropane-1-carboxamide
CID 100782309
methyl 2-(2-methylpropoxy)-5-[(1-phenylcyclopentanecarbonyl)amino]benzoate
CID 100718733
1-(4-methoxyphenyl)-N-(4-propan-2-yloxynaphthalen-1-yl)cyclopentane-1-carboxamide
CID 100744434
N-[4-[(2S)-butan-2-yl]oxynaphthalen-1-yl]-1-(4-methylphenyl)cyclohexane-1-carboxamide
CID 100745808
1-(3-methylphenyl)-N-(4-propoxynaphthalen-1-yl)cyclopentane-1-carboxamide
CID 100720091
5-methyl-N-[4-(2-methylpropoxy)naphthalen-1-yl]-2-oxo-1,3-dioxane-5-carboxamide
CID 100778906
N-(8-methoxyquinolin-5-yl)-1-phenylcyclohexane-1-carboxamide
CID 100770558
trans-(1R,3S)-1-ethoxy-3-methyl-N-[4-(2-methylpropoxy)naphthalen-1-yl]cyclohexane-1-carboxamide
CID 100762995

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-methylpropoxy)naphthalen-1-yl]-1-phenylcyclopentane-1-carboxamide?
The IUPAC name of N-[4-(2-methylpropoxy)naphthalen-1-yl]-1-phenylcyclopentane-1-carboxamide (CID 100719168) is N-[4-(2-methylpropoxy)naphthalen-1-yl]-1-phenylcyclopentane-1-carboxamide.
What is the SMILES notation for N-[4-(2-methylpropoxy)naphthalen-1-yl]-1-phenylcyclopentane-1-carboxamide?
The canonical SMILES for N-[4-(2-methylpropoxy)naphthalen-1-yl]-1-phenylcyclopentane-1-carboxamide is CC(C)COc1ccc(NC(=O)C2(c3ccccc3)CCCC2)c2ccccc12.
What is the InChIKey of N-[4-(2-methylpropoxy)naphthalen-1-yl]-1-phenylcyclopentane-1-carboxamide?
The InChIKey is NKWUYBGNUJELSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H29NO2/c1-19(2)18-29-24-15-14-23(21-12-6-7-13-22(21)24)27-25(28)26(16-8-9-17-26)20-10-4-3-5-11-20/h3-7,10-15,19H,8-9,16-18H2,1-2H3,(H,27,28).
What are the key properties of N-[4-(2-methylpropoxy)naphthalen-1-yl]-1-phenylcyclopentane-1-carboxamide?
N-[4-(2-methylpropoxy)naphthalen-1-yl]-1-phenylcyclopentane-1-carboxamide has a molecular weight of 387.52 g/mol, XLogP of 6.33, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-methylpropoxy)naphthalen-1-yl]-1-phenylcyclopentane-1-carboxamide is sourced from PubChem (CID 100719168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).