2-(3,3-difluoropiperidin-1-yl)-N,N-dimethylethanamine

C9H18F2N2 — CID 117007661

IUPAC2-(3,3-difluoropiperidin-1-yl)-N,N-dimethylethanamine
SMILESCN(C)CCN1CCCC(F)(F)C1
InChIInChI=1S/C9H18F2N2/c1-12(2)6-7-13-5-3-4-9(10,11)8-13/h3-8H2,1-2H3
InChIKeyBBCVJBDKMOVVDJ-UHFFFAOYSA-N
MW192.25 g/mol
LogP1.28
Rot. Bonds3

About 2-(3,3-difluoropiperidin-1-yl)-N,N-dimethylethanamine

2-(3,3-difluoropiperidin-1-yl)-N,N-dimethylethanamine (PubChem CID 117007661) has the molecular formula C9H18F2N2 and a molecular weight of 192.25 g/mol. Its IUPAC name is 2-(3,3-difluoropiperidin-1-yl)-N,N-dimethylethanamine.

Molecular Properties

Compound Name2-(3,3-difluoropiperidin-1-yl)-N,N-dimethylethanamine
PubChem CID117007661
Molecular FormulaC9H18F2N2
Molecular Weight192.25 g/mol
Exact Mass192.14
IUPAC Name2-(3,3-difluoropiperidin-1-yl)-N,N-dimethylethanamine
SMILESCN(C)CCN1CCCC(F)(F)C1
InChIInChI=1S/C9H18F2N2/c1-12(2)6-7-13-5-3-4-9(10,11)8-13/h3-8H2,1-2H3
InChIKeyBBCVJBDKMOVVDJ-UHFFFAOYSA-N
XLogP1.28
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.25
LogP ≤ 51.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-(3,3-difluoropiperidin-1-yl)-N,N-dimethylethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4,4-Difluoro-1-methylpiperidine
CID 23394529
3,3-Difluoro-1-methylpiperidine
CID 23394528
4,4-Difluoro-1-propylpiperidine
CID 45790542
1-(2,2-Difluoropropyl)piperidine
CID 51357996
1-(2-Fluoropropyl)piperidine
CID 101432305
Piperidine, 1-(2-dimethylamino)ethyl-
CID 12294001
1-(3-Piperidin-1-ylpropyl)-4-(2,2,2-trifluoroethyl)-1,4-diazepane
CID 75478926
2,2,3,3,4,4,5,5,6,6-Decafluoro-1-pentylpiperidine
CID 19783528
1-Butyl-2,2,3,3,4,4,5,5,6,6-decafluoropiperidine
CID 19783538
11,11-Difluoro-1,4,7-trimethyl-1,4,7-triazacyclotetradecane
CID 20610173
1-(3-Fluoropropyl)-4-methylpiperazine
CID 20649680
1-(4-Fluorobutyl)-4-methylpiperazine
CID 20649682

Frequently Asked Questions

What is the IUPAC name of 2-(3,3-difluoropiperidin-1-yl)-N,N-dimethylethanamine?
The IUPAC name of 2-(3,3-difluoropiperidin-1-yl)-N,N-dimethylethanamine (CID 117007661) is 2-(3,3-difluoropiperidin-1-yl)-N,N-dimethylethanamine.
What is the SMILES notation for 2-(3,3-difluoropiperidin-1-yl)-N,N-dimethylethanamine?
The canonical SMILES for 2-(3,3-difluoropiperidin-1-yl)-N,N-dimethylethanamine is CN(C)CCN1CCCC(F)(F)C1.
What is the InChIKey of 2-(3,3-difluoropiperidin-1-yl)-N,N-dimethylethanamine?
The InChIKey is BBCVJBDKMOVVDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18F2N2/c1-12(2)6-7-13-5-3-4-9(10,11)8-13/h3-8H2,1-2H3.
What are the key properties of 2-(3,3-difluoropiperidin-1-yl)-N,N-dimethylethanamine?
2-(3,3-difluoropiperidin-1-yl)-N,N-dimethylethanamine has a molecular weight of 192.25 g/mol, XLogP of 1.28, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,3-difluoropiperidin-1-yl)-N,N-dimethylethanamine is sourced from PubChem (CID 117007661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).