N-ethyl-3-(furan-2-yl)propanamide

C9H13NO2 — CID 60690706

IUPACN-ethyl-3-(furan-2-yl)propanamide
SMILESCCNC(=O)CCc1ccco1
InChIInChI=1S/C9H13NO2/c1-2-10-9(11)6-5-8-4-3-7-12-8/h3-4,7H,2,5-6H2,1H3,(H,10,11)
InChIKeyQJWWPNPGICWHDD-UHFFFAOYSA-N
MW167.21 g/mol
LogP1.35
Rot. Bonds4

About N-ethyl-3-(furan-2-yl)propanamide

N-ethyl-3-(furan-2-yl)propanamide (PubChem CID 60690706) has the molecular formula C9H13NO2 and a molecular weight of 167.21 g/mol. Its IUPAC name is N-ethyl-3-(furan-2-yl)propanamide.

Molecular Properties

Compound NameN-ethyl-3-(furan-2-yl)propanamide
PubChem CID60690706
Molecular FormulaC9H13NO2
Molecular Weight167.21 g/mol
Exact Mass167.09
IUPAC NameN-ethyl-3-(furan-2-yl)propanamide
SMILESCCNC(=O)CCc1ccco1
InChIInChI=1S/C9H13NO2/c1-2-10-9(11)6-5-8-4-3-7-12-8/h3-4,7H,2,5-6H2,1H3,(H,10,11)
InChIKeyQJWWPNPGICWHDD-UHFFFAOYSA-N
XLogP1.35
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.21
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-(furan-2-yl)propanamide?
The IUPAC name of N-ethyl-3-(furan-2-yl)propanamide (CID 60690706) is N-ethyl-3-(furan-2-yl)propanamide.
What is the SMILES notation for N-ethyl-3-(furan-2-yl)propanamide?
The canonical SMILES for N-ethyl-3-(furan-2-yl)propanamide is CCNC(=O)CCc1ccco1.
What is the InChIKey of N-ethyl-3-(furan-2-yl)propanamide?
The InChIKey is QJWWPNPGICWHDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO2/c1-2-10-9(11)6-5-8-4-3-7-12-8/h3-4,7H,2,5-6H2,1H3,(H,10,11).
What are the key properties of N-ethyl-3-(furan-2-yl)propanamide?
N-ethyl-3-(furan-2-yl)propanamide has a molecular weight of 167.21 g/mol, XLogP of 1.35, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-(furan-2-yl)propanamide is sourced from PubChem (CID 60690706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).