N-ethyl-3-fluoro-1-methyl-N-propan-2-ylpiperidin-4-amine

C11H23FN2 — CID 59289594

IUPACN-ethyl-3-fluoro-1-methyl-N-propan-2-ylpiperidin-4-amine
SMILESCCN(C(C)C)C1CCN(C)CC1F
InChIInChI=1S/C11H23FN2/c1-5-14(9(2)3)11-6-7-13(4)8-10(11)12/h9-11H,5-8H2,1-4H3
InChIKeyPXAXAMXVUHKJSG-UHFFFAOYSA-N
MW202.32 g/mol
LogP1.76
Rot. Bonds3

About N-ethyl-3-fluoro-1-methyl-N-propan-2-ylpiperidin-4-amine

N-ethyl-3-fluoro-1-methyl-N-propan-2-ylpiperidin-4-amine (PubChem CID 59289594) has the molecular formula C11H23FN2 and a molecular weight of 202.32 g/mol. Its IUPAC name is N-ethyl-3-fluoro-1-methyl-N-propan-2-ylpiperidin-4-amine.

Molecular Properties

Compound NameN-ethyl-3-fluoro-1-methyl-N-propan-2-ylpiperidin-4-amine
PubChem CID59289594
Molecular FormulaC11H23FN2
Molecular Weight202.32 g/mol
Exact Mass202.18
IUPAC NameN-ethyl-3-fluoro-1-methyl-N-propan-2-ylpiperidin-4-amine
SMILESCCN(C(C)C)C1CCN(C)CC1F
InChIInChI=1S/C11H23FN2/c1-5-14(9(2)3)11-6-7-13(4)8-10(11)12/h9-11H,5-8H2,1-4H3
InChIKeyPXAXAMXVUHKJSG-UHFFFAOYSA-N
XLogP1.76
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.32
LogP ≤ 51.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclohexyl-1-ethyl-N-methyl-4-piperidinamine
CID 783843
N-Isopropylpiperidine
CID 240410
1-Ethyl-2-methylpiperidine
CID 522625
1-(2-Fluoropropyl)piperidine
CID 101432305
1-Propyl-4-(1-pyrrolidinyl)piperidine
CID 742600
1'-Isopropyl-1,4'-bipiperidine
CID 766862
Cambridge id 5452134
CID 783765
1'-Ethyl-1,4'-bipiperidine
CID 784001
1'-Methyl-1,4'-bipiperidine
CID 870793
Piperidine, 1-butyl-2-methyl
CID 6428880
Piperidine, 1-hexyl-2-methyl
CID 6428888
Piperidine, 2-methyl-1-pentyl
CID 6428893

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-fluoro-1-methyl-N-propan-2-ylpiperidin-4-amine?
The IUPAC name of N-ethyl-3-fluoro-1-methyl-N-propan-2-ylpiperidin-4-amine (CID 59289594) is N-ethyl-3-fluoro-1-methyl-N-propan-2-ylpiperidin-4-amine.
What is the SMILES notation for N-ethyl-3-fluoro-1-methyl-N-propan-2-ylpiperidin-4-amine?
The canonical SMILES for N-ethyl-3-fluoro-1-methyl-N-propan-2-ylpiperidin-4-amine is CCN(C(C)C)C1CCN(C)CC1F.
What is the InChIKey of N-ethyl-3-fluoro-1-methyl-N-propan-2-ylpiperidin-4-amine?
The InChIKey is PXAXAMXVUHKJSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23FN2/c1-5-14(9(2)3)11-6-7-13(4)8-10(11)12/h9-11H,5-8H2,1-4H3.
What are the key properties of N-ethyl-3-fluoro-1-methyl-N-propan-2-ylpiperidin-4-amine?
N-ethyl-3-fluoro-1-methyl-N-propan-2-ylpiperidin-4-amine has a molecular weight of 202.32 g/mol, XLogP of 1.76, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-fluoro-1-methyl-N-propan-2-ylpiperidin-4-amine is sourced from PubChem (CID 59289594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).