N-(3-fluoropropyl)-3-methoxypiperidine-1-carboxamide

C10H19FN2O2 — CID 75439641

IUPACN-(3-fluoropropyl)-3-methoxypiperidine-1-carboxamide
SMILESCOC1CCCN(C(=O)NCCCF)C1
InChIInChI=1S/C10H19FN2O2/c1-15-9-4-2-7-13(8-9)10(14)12-6-3-5-11/h9H,2-8H2,1H3,(H,12,14)
InChIKeySLGFKKFOYTUBQL-UHFFFAOYSA-N
MW218.27 g/mol
LogP1.17
Rot. Bonds4

About N-(3-fluoropropyl)-3-methoxypiperidine-1-carboxamide

N-(3-fluoropropyl)-3-methoxypiperidine-1-carboxamide (PubChem CID 75439641) has the molecular formula C10H19FN2O2 and a molecular weight of 218.27 g/mol. Its IUPAC name is N-(3-fluoropropyl)-3-methoxypiperidine-1-carboxamide.

Molecular Properties

Compound NameN-(3-fluoropropyl)-3-methoxypiperidine-1-carboxamide
PubChem CID75439641
Molecular FormulaC10H19FN2O2
Molecular Weight218.27 g/mol
Exact Mass218.14
IUPAC NameN-(3-fluoropropyl)-3-methoxypiperidine-1-carboxamide
SMILESCOC1CCCN(C(=O)NCCCF)C1
InChIInChI=1S/C10H19FN2O2/c1-15-9-4-2-7-13(8-9)10(14)12-6-3-5-11/h9H,2-8H2,1H3,(H,12,14)
InChIKeySLGFKKFOYTUBQL-UHFFFAOYSA-N
XLogP1.17
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.27
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(3-fluoropropyl)-3-methoxypiperidine-1-carboxamide?
The IUPAC name of N-(3-fluoropropyl)-3-methoxypiperidine-1-carboxamide (CID 75439641) is N-(3-fluoropropyl)-3-methoxypiperidine-1-carboxamide.
What is the SMILES notation for N-(3-fluoropropyl)-3-methoxypiperidine-1-carboxamide?
The canonical SMILES for N-(3-fluoropropyl)-3-methoxypiperidine-1-carboxamide is COC1CCCN(C(=O)NCCCF)C1.
What is the InChIKey of N-(3-fluoropropyl)-3-methoxypiperidine-1-carboxamide?
The InChIKey is SLGFKKFOYTUBQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19FN2O2/c1-15-9-4-2-7-13(8-9)10(14)12-6-3-5-11/h9H,2-8H2,1H3,(H,12,14).
What are the key properties of N-(3-fluoropropyl)-3-methoxypiperidine-1-carboxamide?
N-(3-fluoropropyl)-3-methoxypiperidine-1-carboxamide has a molecular weight of 218.27 g/mol, XLogP of 1.17, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluoropropyl)-3-methoxypiperidine-1-carboxamide is sourced from PubChem (CID 75439641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).