N-cyclopentyl-N-ethyl-3-fluoro-4-methoxybenzamide

C15H20FNO2 — CID 86926983

IUPACN-cyclopentyl-N-ethyl-3-fluoro-4-methoxybenzamide
SMILESCCN(C(=O)c1ccc(OC)c(F)c1)C1CCCC1
InChIInChI=1S/C15H20FNO2/c1-3-17(12-6-4-5-7-12)15(18)11-8-9-14(19-2)13(16)10-11/h8-10,12H,3-7H2,1-2H3
InChIKeyKZBPXPQZJWFDCT-UHFFFAOYSA-N
MW265.33 g/mol
LogP3.24
Rot. Bonds4

About N-cyclopentyl-N-ethyl-3-fluoro-4-methoxybenzamide

N-cyclopentyl-N-ethyl-3-fluoro-4-methoxybenzamide (PubChem CID 86926983) has the molecular formula C15H20FNO2 and a molecular weight of 265.33 g/mol. Its IUPAC name is N-cyclopentyl-N-ethyl-3-fluoro-4-methoxybenzamide.

Molecular Properties

Compound NameN-cyclopentyl-N-ethyl-3-fluoro-4-methoxybenzamide
PubChem CID86926983
Molecular FormulaC15H20FNO2
Molecular Weight265.33 g/mol
Exact Mass265.15
IUPAC NameN-cyclopentyl-N-ethyl-3-fluoro-4-methoxybenzamide
SMILESCCN(C(=O)c1ccc(OC)c(F)c1)C1CCCC1
InChIInChI=1S/C15H20FNO2/c1-3-17(12-6-4-5-7-12)15(18)11-8-9-14(19-2)13(16)10-11/h8-10,12H,3-7H2,1-2H3
InChIKeyKZBPXPQZJWFDCT-UHFFFAOYSA-N
XLogP3.24
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.33
LogP ≤ 53.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-N-ethyl-3-fluoro-4-methoxybenzamide?
The IUPAC name of N-cyclopentyl-N-ethyl-3-fluoro-4-methoxybenzamide (CID 86926983) is N-cyclopentyl-N-ethyl-3-fluoro-4-methoxybenzamide.
What is the SMILES notation for N-cyclopentyl-N-ethyl-3-fluoro-4-methoxybenzamide?
The canonical SMILES for N-cyclopentyl-N-ethyl-3-fluoro-4-methoxybenzamide is CCN(C(=O)c1ccc(OC)c(F)c1)C1CCCC1.
What is the InChIKey of N-cyclopentyl-N-ethyl-3-fluoro-4-methoxybenzamide?
The InChIKey is KZBPXPQZJWFDCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20FNO2/c1-3-17(12-6-4-5-7-12)15(18)11-8-9-14(19-2)13(16)10-11/h8-10,12H,3-7H2,1-2H3.
What are the key properties of N-cyclopentyl-N-ethyl-3-fluoro-4-methoxybenzamide?
N-cyclopentyl-N-ethyl-3-fluoro-4-methoxybenzamide has a molecular weight of 265.33 g/mol, XLogP of 3.24, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-N-ethyl-3-fluoro-4-methoxybenzamide is sourced from PubChem (CID 86926983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).