N-[(4-fluoropiperidin-4-yl)methyl]-2-methylpropan-2-amine

C10H21FN2 — CID 58266465

IUPACN-[(4-fluoropiperidin-4-yl)methyl]-2-methylpropan-2-amine
SMILESCC(C)(C)NCC1(F)CCNCC1
InChIInChI=1S/C10H21FN2/c1-9(2,3)13-8-10(11)4-6-12-7-5-10/h12-13H,4-8H2,1-3H3
InChIKeyAWLYNFWMINZVDT-UHFFFAOYSA-N
MW188.29 g/mol
LogP1.47
Rot. Bonds2

About N-[(4-fluoropiperidin-4-yl)methyl]-2-methylpropan-2-amine

N-[(4-fluoropiperidin-4-yl)methyl]-2-methylpropan-2-amine (PubChem CID 58266465) has the molecular formula C10H21FN2 and a molecular weight of 188.29 g/mol. Its IUPAC name is N-[(4-fluoropiperidin-4-yl)methyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[(4-fluoropiperidin-4-yl)methyl]-2-methylpropan-2-amine
PubChem CID58266465
Molecular FormulaC10H21FN2
Molecular Weight188.29 g/mol
Exact Mass188.17
IUPAC NameN-[(4-fluoropiperidin-4-yl)methyl]-2-methylpropan-2-amine
SMILESCC(C)(C)NCC1(F)CCNCC1
InChIInChI=1S/C10H21FN2/c1-9(2,3)13-8-10(11)4-6-12-7-5-10/h12-13H,4-8H2,1-3H3
InChIKeyAWLYNFWMINZVDT-UHFFFAOYSA-N
XLogP1.47
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.29
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[(4-fluoropiperidin-4-yl)methyl]-2-methylpropan-2-amine?
The IUPAC name of N-[(4-fluoropiperidin-4-yl)methyl]-2-methylpropan-2-amine (CID 58266465) is N-[(4-fluoropiperidin-4-yl)methyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[(4-fluoropiperidin-4-yl)methyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[(4-fluoropiperidin-4-yl)methyl]-2-methylpropan-2-amine is CC(C)(C)NCC1(F)CCNCC1.
What is the InChIKey of N-[(4-fluoropiperidin-4-yl)methyl]-2-methylpropan-2-amine?
The InChIKey is AWLYNFWMINZVDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21FN2/c1-9(2,3)13-8-10(11)4-6-12-7-5-10/h12-13H,4-8H2,1-3H3.
What are the key properties of N-[(4-fluoropiperidin-4-yl)methyl]-2-methylpropan-2-amine?
N-[(4-fluoropiperidin-4-yl)methyl]-2-methylpropan-2-amine has a molecular weight of 188.29 g/mol, XLogP of 1.47, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-fluoropiperidin-4-yl)methyl]-2-methylpropan-2-amine is sourced from PubChem (CID 58266465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).