N-[1-(2-methoxyphenyl)cyclopropyl]cyclopropanecarboxamide

C14H17NO2 — CID 110445612

IUPACN-[1-(2-methoxyphenyl)cyclopropyl]cyclopropanecarboxamide
SMILESCOc1ccccc1C1(NC(=O)C2CC2)CC1
InChIInChI=1S/C14H17NO2/c1-17-12-5-3-2-4-11(12)14(8-9-14)15-13(16)10-6-7-10/h2-5,10H,6-9H2,1H3,(H,15,16)
InChIKeyBEDOWIQDIJFWRW-UHFFFAOYSA-N
MW231.29 g/mol
LogP2.21
Rot. Bonds4

About N-[1-(2-methoxyphenyl)cyclopropyl]cyclopropanecarboxamide

N-[1-(2-methoxyphenyl)cyclopropyl]cyclopropanecarboxamide (PubChem CID 110445612) has the molecular formula C14H17NO2 and a molecular weight of 231.29 g/mol. Its IUPAC name is N-[1-(2-methoxyphenyl)cyclopropyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[1-(2-methoxyphenyl)cyclopropyl]cyclopropanecarboxamide
PubChem CID110445612
Molecular FormulaC14H17NO2
Molecular Weight231.29 g/mol
Exact Mass231.13
IUPAC NameN-[1-(2-methoxyphenyl)cyclopropyl]cyclopropanecarboxamide
SMILESCOc1ccccc1C1(NC(=O)C2CC2)CC1
InChIInChI=1S/C14H17NO2/c1-17-12-5-3-2-4-11(12)14(8-9-14)15-13(16)10-6-7-10/h2-5,10H,6-9H2,1H3,(H,15,16)
InChIKeyBEDOWIQDIJFWRW-UHFFFAOYSA-N
XLogP2.21
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.29
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[1-(2-methoxyphenyl)cyclopropyl]cyclopropanecarboxamide?
The IUPAC name of N-[1-(2-methoxyphenyl)cyclopropyl]cyclopropanecarboxamide (CID 110445612) is N-[1-(2-methoxyphenyl)cyclopropyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[1-(2-methoxyphenyl)cyclopropyl]cyclopropanecarboxamide?
The canonical SMILES for N-[1-(2-methoxyphenyl)cyclopropyl]cyclopropanecarboxamide is COc1ccccc1C1(NC(=O)C2CC2)CC1.
What is the InChIKey of N-[1-(2-methoxyphenyl)cyclopropyl]cyclopropanecarboxamide?
The InChIKey is BEDOWIQDIJFWRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO2/c1-17-12-5-3-2-4-11(12)14(8-9-14)15-13(16)10-6-7-10/h2-5,10H,6-9H2,1H3,(H,15,16).
What are the key properties of N-[1-(2-methoxyphenyl)cyclopropyl]cyclopropanecarboxamide?
N-[1-(2-methoxyphenyl)cyclopropyl]cyclopropanecarboxamide has a molecular weight of 231.29 g/mol, XLogP of 2.21, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-methoxyphenyl)cyclopropyl]cyclopropanecarboxamide is sourced from PubChem (CID 110445612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).