N-[2-(furan-2-yl)ethyl]-N-methylcyclobutanecarboxamide

C12H17NO2 — CID 110733326

IUPACN-[2-(furan-2-yl)ethyl]-N-methylcyclobutanecarboxamide
SMILESCN(CCc1ccco1)C(=O)C1CCC1
InChIInChI=1S/C12H17NO2/c1-13(12(14)10-4-2-5-10)8-7-11-6-3-9-15-11/h3,6,9-10H,2,4-5,7-8H2,1H3
InChIKeyCWZIONSHFZHOJY-UHFFFAOYSA-N
MW207.27 g/mol
LogP2.08
Rot. Bonds4

About N-[2-(furan-2-yl)ethyl]-N-methylcyclobutanecarboxamide

N-[2-(furan-2-yl)ethyl]-N-methylcyclobutanecarboxamide (PubChem CID 110733326) has the molecular formula C12H17NO2 and a molecular weight of 207.27 g/mol. Its IUPAC name is N-[2-(furan-2-yl)ethyl]-N-methylcyclobutanecarboxamide.

Molecular Properties

Compound NameN-[2-(furan-2-yl)ethyl]-N-methylcyclobutanecarboxamide
PubChem CID110733326
Molecular FormulaC12H17NO2
Molecular Weight207.27 g/mol
Exact Mass207.13
IUPAC NameN-[2-(furan-2-yl)ethyl]-N-methylcyclobutanecarboxamide
SMILESCN(CCc1ccco1)C(=O)C1CCC1
InChIInChI=1S/C12H17NO2/c1-13(12(14)10-4-2-5-10)8-7-11-6-3-9-15-11/h3,6,9-10H,2,4-5,7-8H2,1H3
InChIKeyCWZIONSHFZHOJY-UHFFFAOYSA-N
XLogP2.08
TPSA33.45 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.27
LogP ≤ 52.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[2-(furan-2-yl)ethyl]-N-methylcyclobutanecarboxamide?
The IUPAC name of N-[2-(furan-2-yl)ethyl]-N-methylcyclobutanecarboxamide (CID 110733326) is N-[2-(furan-2-yl)ethyl]-N-methylcyclobutanecarboxamide.
What is the SMILES notation for N-[2-(furan-2-yl)ethyl]-N-methylcyclobutanecarboxamide?
The canonical SMILES for N-[2-(furan-2-yl)ethyl]-N-methylcyclobutanecarboxamide is CN(CCc1ccco1)C(=O)C1CCC1.
What is the InChIKey of N-[2-(furan-2-yl)ethyl]-N-methylcyclobutanecarboxamide?
The InChIKey is CWZIONSHFZHOJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO2/c1-13(12(14)10-4-2-5-10)8-7-11-6-3-9-15-11/h3,6,9-10H,2,4-5,7-8H2,1H3.
What are the key properties of N-[2-(furan-2-yl)ethyl]-N-methylcyclobutanecarboxamide?
N-[2-(furan-2-yl)ethyl]-N-methylcyclobutanecarboxamide has a molecular weight of 207.27 g/mol, XLogP of 2.08, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(furan-2-yl)ethyl]-N-methylcyclobutanecarboxamide is sourced from PubChem (CID 110733326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).