[4-(fluoromethyl)-1-methylpiperidin-4-yl]methanamine

C8H17FN2 — CID 83854316

IUPAC[4-(fluoromethyl)-1-methylpiperidin-4-yl]methanamine
SMILESCN1CCC(CN)(CF)CC1
InChIInChI=1S/C8H17FN2/c1-11-4-2-8(6-9,7-10)3-5-11/h2-7,10H2,1H3
InChIKeyUSLZVXJYZAXGMX-UHFFFAOYSA-N
MW160.24 g/mol
LogP0.63
Rot. Bonds2

About [4-(fluoromethyl)-1-methylpiperidin-4-yl]methanamine

[4-(fluoromethyl)-1-methylpiperidin-4-yl]methanamine (PubChem CID 83854316) has the molecular formula C8H17FN2 and a molecular weight of 160.24 g/mol. Its IUPAC name is [4-(fluoromethyl)-1-methylpiperidin-4-yl]methanamine.

Molecular Properties

Compound Name[4-(fluoromethyl)-1-methylpiperidin-4-yl]methanamine
PubChem CID83854316
Molecular FormulaC8H17FN2
Molecular Weight160.24 g/mol
Exact Mass160.14
IUPAC Name[4-(fluoromethyl)-1-methylpiperidin-4-yl]methanamine
SMILESCN1CCC(CN)(CF)CC1
InChIInChI=1S/C8H17FN2/c1-11-4-2-8(6-9,7-10)3-5-11/h2-7,10H2,1H3
InChIKeyUSLZVXJYZAXGMX-UHFFFAOYSA-N
XLogP0.63
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.24
LogP ≤ 50.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1,4-Dimethylpiperidin-4-yl)methanamine
CID 20759990
2-(1-Ethylpiperidin-4-yl)ethan-1-amine
CID 21643902
[1-(3-Methylbutyl)piperidin-4-yl]methanamine
CID 24274890
(1-Ethylpiperidin-4-yl)methanamine
CID 2794704
(1-Propylpiperidin-4-yl)methanamine
CID 3164324
4-(4-Methylpiperidin-1-yl)butan-1-amine
CID 7138415
4-Aminomethyl-1-N-butylpiperidine
CID 10442133
4-Ethyl-4-methylpiperidine
CID 17750882
1-(1-Isobutylpiperidin-4-YL)methanamine
CID 22992230
2-(1-Propylpiperidin-4-Yl)Ethanamine
CID 28063562
2-(4,4-Dimethylpiperidin-1-yl)ethan-1-amine
CID 62936164
Dimethyl((4-methylpiperidin-4-yl)methyl)amine
CID 63122792

Frequently Asked Questions

What is the IUPAC name of [4-(fluoromethyl)-1-methylpiperidin-4-yl]methanamine?
The IUPAC name of [4-(fluoromethyl)-1-methylpiperidin-4-yl]methanamine (CID 83854316) is [4-(fluoromethyl)-1-methylpiperidin-4-yl]methanamine.
What is the SMILES notation for [4-(fluoromethyl)-1-methylpiperidin-4-yl]methanamine?
The canonical SMILES for [4-(fluoromethyl)-1-methylpiperidin-4-yl]methanamine is CN1CCC(CN)(CF)CC1.
What is the InChIKey of [4-(fluoromethyl)-1-methylpiperidin-4-yl]methanamine?
The InChIKey is USLZVXJYZAXGMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17FN2/c1-11-4-2-8(6-9,7-10)3-5-11/h2-7,10H2,1H3.
What are the key properties of [4-(fluoromethyl)-1-methylpiperidin-4-yl]methanamine?
[4-(fluoromethyl)-1-methylpiperidin-4-yl]methanamine has a molecular weight of 160.24 g/mol, XLogP of 0.63, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(fluoromethyl)-1-methylpiperidin-4-yl]methanamine is sourced from PubChem (CID 83854316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).