N-[2-(7-methoxynaphthalen-1-yl)cyclopropyl]cyclopropanecarboxamide

C18H19NO2 — CID 10221363

IUPACN-[2-(7-methoxynaphthalen-1-yl)cyclopropyl]cyclopropanecarboxamide
SMILESCOc1ccc2cccc(C3CC3NC(=O)C3CC3)c2c1
InChIInChI=1S/C18H19NO2/c1-21-13-8-7-11-3-2-4-14(15(11)9-13)16-10-17(16)19-18(20)12-5-6-12/h2-4,7-9,12,16-17H,5-6,10H2,1H3,(H,19,20)
InChIKeyWFOBJJJBCKGMFL-UHFFFAOYSA-N
MW281.36 g/mol
LogP3.23
Rot. Bonds4

About N-[2-(7-methoxynaphthalen-1-yl)cyclopropyl]cyclopropanecarboxamide

N-[2-(7-methoxynaphthalen-1-yl)cyclopropyl]cyclopropanecarboxamide (PubChem CID 10221363) has the molecular formula C18H19NO2 and a molecular weight of 281.36 g/mol. Its IUPAC name is N-[2-(7-methoxynaphthalen-1-yl)cyclopropyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[2-(7-methoxynaphthalen-1-yl)cyclopropyl]cyclopropanecarboxamide
PubChem CID10221363
Molecular FormulaC18H19NO2
Molecular Weight281.36 g/mol
Exact Mass281.14
IUPAC NameN-[2-(7-methoxynaphthalen-1-yl)cyclopropyl]cyclopropanecarboxamide
SMILESCOc1ccc2cccc(C3CC3NC(=O)C3CC3)c2c1
InChIInChI=1S/C18H19NO2/c1-21-13-8-7-11-3-2-4-14(15(11)9-13)16-10-17(16)19-18(20)12-5-6-12/h2-4,7-9,12,16-17H,5-6,10H2,1H3,(H,19,20)
InChIKeyWFOBJJJBCKGMFL-UHFFFAOYSA-N
XLogP3.23
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[2-(7-methoxynaphthalen-1-yl)cyclopropyl]cyclopropanecarboxamide?
The IUPAC name of N-[2-(7-methoxynaphthalen-1-yl)cyclopropyl]cyclopropanecarboxamide (CID 10221363) is N-[2-(7-methoxynaphthalen-1-yl)cyclopropyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[2-(7-methoxynaphthalen-1-yl)cyclopropyl]cyclopropanecarboxamide?
The canonical SMILES for N-[2-(7-methoxynaphthalen-1-yl)cyclopropyl]cyclopropanecarboxamide is COc1ccc2cccc(C3CC3NC(=O)C3CC3)c2c1.
What is the InChIKey of N-[2-(7-methoxynaphthalen-1-yl)cyclopropyl]cyclopropanecarboxamide?
The InChIKey is WFOBJJJBCKGMFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19NO2/c1-21-13-8-7-11-3-2-4-14(15(11)9-13)16-10-17(16)19-18(20)12-5-6-12/h2-4,7-9,12,16-17H,5-6,10H2,1H3,(H,19,20).
What are the key properties of N-[2-(7-methoxynaphthalen-1-yl)cyclopropyl]cyclopropanecarboxamide?
N-[2-(7-methoxynaphthalen-1-yl)cyclopropyl]cyclopropanecarboxamide has a molecular weight of 281.36 g/mol, XLogP of 3.23, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(7-methoxynaphthalen-1-yl)cyclopropyl]cyclopropanecarboxamide is sourced from PubChem (CID 10221363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).