N-cyclopentyl-3-(fluoromethyl)-N-methylazetidine-1-carboxamide

C11H19FN2O — CID 126794063

IUPACN-cyclopentyl-3-(fluoromethyl)-N-methylazetidine-1-carboxamide
SMILESCN(C(=O)N1CC(CF)C1)C1CCCC1
InChIInChI=1S/C11H19FN2O/c1-13(10-4-2-3-5-10)11(15)14-7-9(6-12)8-14/h9-10H,2-8H2,1H3
InChIKeyZIBXQAIXXMREAT-UHFFFAOYSA-N
MW214.28 g/mol
LogP1.88
Rot. Bonds2

About N-cyclopentyl-3-(fluoromethyl)-N-methylazetidine-1-carboxamide

N-cyclopentyl-3-(fluoromethyl)-N-methylazetidine-1-carboxamide (PubChem CID 126794063) has the molecular formula C11H19FN2O and a molecular weight of 214.28 g/mol. Its IUPAC name is N-cyclopentyl-3-(fluoromethyl)-N-methylazetidine-1-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-3-(fluoromethyl)-N-methylazetidine-1-carboxamide
PubChem CID126794063
Molecular FormulaC11H19FN2O
Molecular Weight214.28 g/mol
Exact Mass214.15
IUPAC NameN-cyclopentyl-3-(fluoromethyl)-N-methylazetidine-1-carboxamide
SMILESCN(C(=O)N1CC(CF)C1)C1CCCC1
InChIInChI=1S/C11H19FN2O/c1-13(10-4-2-3-5-10)11(15)14-7-9(6-12)8-14/h9-10H,2-8H2,1H3
InChIKeyZIBXQAIXXMREAT-UHFFFAOYSA-N
XLogP1.88
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.28
LogP ≤ 51.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-3-(fluoromethyl)-N-methylazetidine-1-carboxamide?
The IUPAC name of N-cyclopentyl-3-(fluoromethyl)-N-methylazetidine-1-carboxamide (CID 126794063) is N-cyclopentyl-3-(fluoromethyl)-N-methylazetidine-1-carboxamide.
What is the SMILES notation for N-cyclopentyl-3-(fluoromethyl)-N-methylazetidine-1-carboxamide?
The canonical SMILES for N-cyclopentyl-3-(fluoromethyl)-N-methylazetidine-1-carboxamide is CN(C(=O)N1CC(CF)C1)C1CCCC1.
What is the InChIKey of N-cyclopentyl-3-(fluoromethyl)-N-methylazetidine-1-carboxamide?
The InChIKey is ZIBXQAIXXMREAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19FN2O/c1-13(10-4-2-3-5-10)11(15)14-7-9(6-12)8-14/h9-10H,2-8H2,1H3.
What are the key properties of N-cyclopentyl-3-(fluoromethyl)-N-methylazetidine-1-carboxamide?
N-cyclopentyl-3-(fluoromethyl)-N-methylazetidine-1-carboxamide has a molecular weight of 214.28 g/mol, XLogP of 1.88, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-3-(fluoromethyl)-N-methylazetidine-1-carboxamide is sourced from PubChem (CID 126794063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).