N-(4-methoxynaphthalen-1-yl)-1-phenylcyclopropane-1-carboxamide

C21H19NO2 — CID 100782309

IUPACN-(4-methoxynaphthalen-1-yl)-1-phenylcyclopropane-1-carboxamide
SMILESCOc1ccc(NC(=O)C2(c3ccccc3)CC2)c2ccccc12
InChIInChI=1S/C21H19NO2/c1-24-19-12-11-18(16-9-5-6-10-17(16)19)22-20(23)21(13-14-21)15-7-3-2-4-8-15/h2-12H,13-14H2,1H3,(H,22,23)
InChIKeyPMFVJKQTHZHEBL-UHFFFAOYSA-N
MW317.39 g/mol
LogP4.52
Rot. Bonds4

About N-(4-methoxynaphthalen-1-yl)-1-phenylcyclopropane-1-carboxamide

N-(4-methoxynaphthalen-1-yl)-1-phenylcyclopropane-1-carboxamide (PubChem CID 100782309) has the molecular formula C21H19NO2 and a molecular weight of 317.39 g/mol. Its IUPAC name is N-(4-methoxynaphthalen-1-yl)-1-phenylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-(4-methoxynaphthalen-1-yl)-1-phenylcyclopropane-1-carboxamide
PubChem CID100782309
Molecular FormulaC21H19NO2
Molecular Weight317.39 g/mol
Exact Mass317.14
IUPAC NameN-(4-methoxynaphthalen-1-yl)-1-phenylcyclopropane-1-carboxamide
SMILESCOc1ccc(NC(=O)C2(c3ccccc3)CC2)c2ccccc12
InChIInChI=1S/C21H19NO2/c1-24-19-12-11-18(16-9-5-6-10-17(16)19)22-20(23)21(13-14-21)15-7-3-2-4-8-15/h2-12H,13-14H2,1H3,(H,22,23)
InChIKeyPMFVJKQTHZHEBL-UHFFFAOYSA-N
XLogP4.52
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.39
LogP ≤ 54.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 100770558
N-[4-(2-methylpropoxy)naphthalen-1-yl]-1-phenylcyclopentane-1-carboxamide
CID 100719168
1-(4-methoxyphenyl)-N-(4-propan-2-yloxynaphthalen-1-yl)cyclopentane-1-carboxamide
CID 100744434
N-(2-methoxydibenzofuran-3-yl)-1-phenylcyclopropane-1-carboxamide
CID 9098188
N-(4-ethoxynaphthalen-1-yl)-4-(4-methoxyphenyl)oxane-4-carboxamide
CID 100750314
1-(4-chlorophenyl)-N-[4-(2-methylpropoxy)naphthalen-1-yl]cyclopropane-1-carboxamide
CID 100782430
1-(4-methoxyphenyl)-N-[4-(2-methylpropoxy)naphthalen-1-yl]cyclohexane-1-carboxamide
CID 100747706
N-naphthalen-1-yl-1-phenylcyclobutane-1-carboxamide
CID 32618502
2-methoxy-N-(4-methoxynaphthalen-1-yl)-2-methylpropanamide
CID 100752361
1-(3-methylphenyl)-N-(4-propoxynaphthalen-1-yl)cyclopentane-1-carboxamide
CID 100720091
N-[4-[(2S)-butan-2-yl]oxynaphthalen-1-yl]-1-(4-methylphenyl)cyclohexane-1-carboxamide
CID 100745808
N-(4-methoxynaphthalen-1-yl)-4-phenylbenzamide
CID 1190439

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxynaphthalen-1-yl)-1-phenylcyclopropane-1-carboxamide?
The IUPAC name of N-(4-methoxynaphthalen-1-yl)-1-phenylcyclopropane-1-carboxamide (CID 100782309) is N-(4-methoxynaphthalen-1-yl)-1-phenylcyclopropane-1-carboxamide.
What is the SMILES notation for N-(4-methoxynaphthalen-1-yl)-1-phenylcyclopropane-1-carboxamide?
The canonical SMILES for N-(4-methoxynaphthalen-1-yl)-1-phenylcyclopropane-1-carboxamide is COc1ccc(NC(=O)C2(c3ccccc3)CC2)c2ccccc12.
What is the InChIKey of N-(4-methoxynaphthalen-1-yl)-1-phenylcyclopropane-1-carboxamide?
The InChIKey is PMFVJKQTHZHEBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19NO2/c1-24-19-12-11-18(16-9-5-6-10-17(16)19)22-20(23)21(13-14-21)15-7-3-2-4-8-15/h2-12H,13-14H2,1H3,(H,22,23).
What are the key properties of N-(4-methoxynaphthalen-1-yl)-1-phenylcyclopropane-1-carboxamide?
N-(4-methoxynaphthalen-1-yl)-1-phenylcyclopropane-1-carboxamide has a molecular weight of 317.39 g/mol, XLogP of 4.52, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxynaphthalen-1-yl)-1-phenylcyclopropane-1-carboxamide is sourced from PubChem (CID 100782309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).