N-ethyl-N-[(1-ethylpiperidin-2-yl)methyl]propan-2-amine

C13H28N2 — CID 163258347

IUPACN-ethyl-N-[(1-ethylpiperidin-2-yl)methyl]propan-2-amine
SMILESCCN(CC1CCCCN1CC)C(C)C
InChIInChI=1S/C13H28N2/c1-5-14-10-8-7-9-13(14)11-15(6-2)12(3)4/h12-13H,5-11H2,1-4H3
InChIKeyQFRLSXLCQIRFFB-UHFFFAOYSA-N
MW212.38 g/mol
LogP2.59
Rot. Bonds5

About N-ethyl-N-[(1-ethylpiperidin-2-yl)methyl]propan-2-amine

N-ethyl-N-[(1-ethylpiperidin-2-yl)methyl]propan-2-amine (PubChem CID 163258347) has the molecular formula C13H28N2 and a molecular weight of 212.38 g/mol. Its IUPAC name is N-ethyl-N-[(1-ethylpiperidin-2-yl)methyl]propan-2-amine.

Molecular Properties

Compound NameN-ethyl-N-[(1-ethylpiperidin-2-yl)methyl]propan-2-amine
PubChem CID163258347
Molecular FormulaC13H28N2
Molecular Weight212.38 g/mol
Exact Mass212.23
IUPAC NameN-ethyl-N-[(1-ethylpiperidin-2-yl)methyl]propan-2-amine
SMILESCCN(CC1CCCCN1CC)C(C)C
InChIInChI=1S/C13H28N2/c1-5-14-10-8-7-9-13(14)11-15(6-2)12(3)4/h12-13H,5-11H2,1-4H3
InChIKeyQFRLSXLCQIRFFB-UHFFFAOYSA-N
XLogP2.59
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.38
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(cyclohexa-1,3-dien-1-ylmethyl)-N-[(1-ethylpiperidin-2-yl)methyl]propan-2-amine
CID 163258681
1-ethyl-2-(2-methylpropyl)piperidine
CID 58904573
N-[(1-ethylpiperidin-2-yl)methyl]-N-propylpropan-1-amine
CID 151585652
1,2-diethylpiperidine
CID 19604037
1-(1-ethylpiperidin-2-yl)propan-2-ol
CID 21153789
2-(2-bromopropyl)-1-ethylpiperidine
CID 126979306
1-(1-ethylpiperidin-2-yl)-3-methylbutan-2-amine
CID 83982203
N-[(1-methylpiperidin-2-yl)methyl]-N-propan-2-ylpropan-1-amine
CID 163258007
3-N-[(1-ethylpyrrolidin-2-yl)methyl]-3-N-methylbutane-1,3-diamine
CID 79302990
(1-ethylazepan-2-yl)methanol
CID 2849413
2-[(2S)-1-ethylpiperidin-2-yl]ethanol
CID 26365884
N-propan-2-yl-N-[(1-propylpiperidin-2-yl)methyl]acetamide
CID 163258053

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-[(1-ethylpiperidin-2-yl)methyl]propan-2-amine?
The IUPAC name of N-ethyl-N-[(1-ethylpiperidin-2-yl)methyl]propan-2-amine (CID 163258347) is N-ethyl-N-[(1-ethylpiperidin-2-yl)methyl]propan-2-amine.
What is the SMILES notation for N-ethyl-N-[(1-ethylpiperidin-2-yl)methyl]propan-2-amine?
The canonical SMILES for N-ethyl-N-[(1-ethylpiperidin-2-yl)methyl]propan-2-amine is CCN(CC1CCCCN1CC)C(C)C.
What is the InChIKey of N-ethyl-N-[(1-ethylpiperidin-2-yl)methyl]propan-2-amine?
The InChIKey is QFRLSXLCQIRFFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2/c1-5-14-10-8-7-9-13(14)11-15(6-2)12(3)4/h12-13H,5-11H2,1-4H3.
What are the key properties of N-ethyl-N-[(1-ethylpiperidin-2-yl)methyl]propan-2-amine?
N-ethyl-N-[(1-ethylpiperidin-2-yl)methyl]propan-2-amine has a molecular weight of 212.38 g/mol, XLogP of 2.59, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-[(1-ethylpiperidin-2-yl)methyl]propan-2-amine is sourced from PubChem (CID 163258347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).