N-ethyl-3,3-difluoro-1,5-dimethylpiperidin-4-amine

C9H18F2N2 — CID 176946025

IUPACN-ethyl-3,3-difluoro-1,5-dimethylpiperidin-4-amine
SMILESCCNC1C(C)CN(C)CC1(F)F
InChIInChI=1S/C9H18F2N2/c1-4-12-8-7(2)5-13(3)6-9(8,10)11/h7-8,12H,4-6H2,1-3H3
InChIKeyALTDTDQBAPNYAL-UHFFFAOYSA-N
MW192.25 g/mol
LogP1.18
Rot. Bonds2

About N-ethyl-3,3-difluoro-1,5-dimethylpiperidin-4-amine

N-ethyl-3,3-difluoro-1,5-dimethylpiperidin-4-amine (PubChem CID 176946025) has the molecular formula C9H18F2N2 and a molecular weight of 192.25 g/mol. Its IUPAC name is N-ethyl-3,3-difluoro-1,5-dimethylpiperidin-4-amine.

Molecular Properties

Compound NameN-ethyl-3,3-difluoro-1,5-dimethylpiperidin-4-amine
PubChem CID176946025
Molecular FormulaC9H18F2N2
Molecular Weight192.25 g/mol
Exact Mass192.14
IUPAC NameN-ethyl-3,3-difluoro-1,5-dimethylpiperidin-4-amine
SMILESCCNC1C(C)CN(C)CC1(F)F
InChIInChI=1S/C9H18F2N2/c1-4-12-8-7(2)5-13(3)6-9(8,10)11/h7-8,12H,4-6H2,1-3H3
InChIKeyALTDTDQBAPNYAL-UHFFFAOYSA-N
XLogP1.18
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.25
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(1-Isopropyl-3-piperidinyl)methanamine
CID 3157476
3-Methyl-1,4'-bipiperidine
CID 2760044
1,3-Dimethylpiperidin-4-amine
CID 23008883
Methyl((1-methylpiperidin-3-yl)methyl)amine
CID 16640588
N,N-Dimethyl-1-piperidin-3-ylmethanamine
CID 16768076
1-ethyl-N,3-dimethylpiperidin-4-amine
CID 54595021
(4,4-Difluoro-1-methylpiperidin-3-yl)methanamine
CID 83854893
Diethyl-piperidin-3-ylmethyl-amine
CID 6484181
N-methyl-N-(2,2,2-trifluoroethyl)piperidin-4-amine
CID 43607421
N-(2,2-difluoroethyl)-1-methylpiperidin-4-amine
CID 50896642
N-(2,2-difluoroethyl)-N-methylpiperidin-4-amine dihydrochloride
CID 54595919
N-methyl-N-(2,2,2-trifluoroethyl)piperidin-4-amine hydrochloride
CID 71758336

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3,3-difluoro-1,5-dimethylpiperidin-4-amine?
The IUPAC name of N-ethyl-3,3-difluoro-1,5-dimethylpiperidin-4-amine (CID 176946025) is N-ethyl-3,3-difluoro-1,5-dimethylpiperidin-4-amine.
What is the SMILES notation for N-ethyl-3,3-difluoro-1,5-dimethylpiperidin-4-amine?
The canonical SMILES for N-ethyl-3,3-difluoro-1,5-dimethylpiperidin-4-amine is CCNC1C(C)CN(C)CC1(F)F.
What is the InChIKey of N-ethyl-3,3-difluoro-1,5-dimethylpiperidin-4-amine?
The InChIKey is ALTDTDQBAPNYAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18F2N2/c1-4-12-8-7(2)5-13(3)6-9(8,10)11/h7-8,12H,4-6H2,1-3H3.
What are the key properties of N-ethyl-3,3-difluoro-1,5-dimethylpiperidin-4-amine?
N-ethyl-3,3-difluoro-1,5-dimethylpiperidin-4-amine has a molecular weight of 192.25 g/mol, XLogP of 1.18, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3,3-difluoro-1,5-dimethylpiperidin-4-amine is sourced from PubChem (CID 176946025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).