N-(1-tert-butyl-4-fluoropiperidin-4-yl)formamide

C10H19FN2O — CID 122488103

IUPACN-(1-tert-butyl-4-fluoropiperidin-4-yl)formamide
SMILESCC(C)(C)N1CCC(F)(NC=O)CC1
InChIInChI=1S/C10H19FN2O/c1-9(2,3)13-6-4-10(11,5-7-13)12-8-14/h8H,4-7H2,1-3H3,(H,12,14)
InChIKeyUQHKOMFWYYTADC-UHFFFAOYSA-N
MW202.27 g/mol
LogP1.29
Rot. Bonds2

About N-(1-tert-butyl-4-fluoropiperidin-4-yl)formamide

N-(1-tert-butyl-4-fluoropiperidin-4-yl)formamide (PubChem CID 122488103) has the molecular formula C10H19FN2O and a molecular weight of 202.27 g/mol. Its IUPAC name is N-(1-tert-butyl-4-fluoropiperidin-4-yl)formamide.

Molecular Properties

Compound NameN-(1-tert-butyl-4-fluoropiperidin-4-yl)formamide
PubChem CID122488103
Molecular FormulaC10H19FN2O
Molecular Weight202.27 g/mol
Exact Mass202.15
IUPAC NameN-(1-tert-butyl-4-fluoropiperidin-4-yl)formamide
SMILESCC(C)(C)N1CCC(F)(NC=O)CC1
InChIInChI=1S/C10H19FN2O/c1-9(2,3)13-6-4-10(11,5-7-13)12-8-14/h8H,4-7H2,1-3H3,(H,12,14)
InChIKeyUQHKOMFWYYTADC-UHFFFAOYSA-N
XLogP1.29
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.27
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'N-C-halo', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(1-tert-butyl-4-fluoropiperidin-4-yl)formamide?
The IUPAC name of N-(1-tert-butyl-4-fluoropiperidin-4-yl)formamide (CID 122488103) is N-(1-tert-butyl-4-fluoropiperidin-4-yl)formamide.
What is the SMILES notation for N-(1-tert-butyl-4-fluoropiperidin-4-yl)formamide?
The canonical SMILES for N-(1-tert-butyl-4-fluoropiperidin-4-yl)formamide is CC(C)(C)N1CCC(F)(NC=O)CC1.
What is the InChIKey of N-(1-tert-butyl-4-fluoropiperidin-4-yl)formamide?
The InChIKey is UQHKOMFWYYTADC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19FN2O/c1-9(2,3)13-6-4-10(11,5-7-13)12-8-14/h8H,4-7H2,1-3H3,(H,12,14).
What are the key properties of N-(1-tert-butyl-4-fluoropiperidin-4-yl)formamide?
N-(1-tert-butyl-4-fluoropiperidin-4-yl)formamide has a molecular weight of 202.27 g/mol, XLogP of 1.29, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-tert-butyl-4-fluoropiperidin-4-yl)formamide is sourced from PubChem (CID 122488103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).