N-ethyl-N-methyl-2-(1-propan-2-ylpiperidin-4-yl)ethanamine

C13H28N2 — CID 176717350

IUPACN-ethyl-N-methyl-2-(1-propan-2-ylpiperidin-4-yl)ethanamine
SMILESCCN(C)CCC1CCN(C(C)C)CC1
InChIInChI=1S/C13H28N2/c1-5-14(4)9-6-13-7-10-15(11-8-13)12(2)3/h12-13H,5-11H2,1-4H3
InChIKeyMNILSYZLXILTBE-UHFFFAOYSA-N
MW212.38 g/mol
LogP2.45
Rot. Bonds5

About N-ethyl-N-methyl-2-(1-propan-2-ylpiperidin-4-yl)ethanamine

N-ethyl-N-methyl-2-(1-propan-2-ylpiperidin-4-yl)ethanamine (PubChem CID 176717350) has the molecular formula C13H28N2 and a molecular weight of 212.38 g/mol. Its IUPAC name is N-ethyl-N-methyl-2-(1-propan-2-ylpiperidin-4-yl)ethanamine.

Molecular Properties

Compound NameN-ethyl-N-methyl-2-(1-propan-2-ylpiperidin-4-yl)ethanamine
PubChem CID176717350
Molecular FormulaC13H28N2
Molecular Weight212.38 g/mol
Exact Mass212.23
IUPAC NameN-ethyl-N-methyl-2-(1-propan-2-ylpiperidin-4-yl)ethanamine
SMILESCCN(C)CCC1CCN(C(C)C)CC1
InChIInChI=1S/C13H28N2/c1-5-14(4)9-6-13-7-10-15(11-8-13)12(2)3/h12-13H,5-11H2,1-4H3
InChIKeyMNILSYZLXILTBE-UHFFFAOYSA-N
XLogP2.45
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 ≤ 52.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-propan-2-yl-N-[2-(1-propan-2-ylpiperidin-4-yl)ethyl]butan-2-amine
CID 178057630
[methyl-[3-(1-propan-2-ylpiperidin-4-yl)propyl]amino]methanethiol
CID 170057835
N,2-dimethyl-N-[3-(1-propan-2-ylpiperidin-4-yl)propyl]butan-1-amine
CID 170039726
N-methyl-N-propan-2-yl-3-(1-propan-2-ylpiperidin-4-yl)propan-1-amine
CID 170195980
N-ethyl-2-methyl-N-[3-(1-propan-2-ylpiperidin-4-yl)propyl]propan-1-amine
CID 167231530
4-octyl-1-propan-2-ylpiperidine
CID 167231286
N-ethyl-N-methyl-2-piperidin-4-ylethanamine
CID 43263497
N-iodo-N-methyl-1-(1-propan-2-ylpiperidin-4-yl)methanamine
CID 178102077
4-ethyl-1-[2-(1-propan-2-ylpiperidin-4-yl)ethyl]piperidine
CID 158397131
3-(1-propan-2-ylpiperidin-4-yl)propanal
CID 83906803
N-ethyl-1-propan-2-yl-N-propylpiperidin-4-amine
CID 142371504
2-[4-[2-(dimethylamino)ethyl]piperidin-1-yl]propan-1-amine
CID 83835390

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-methyl-2-(1-propan-2-ylpiperidin-4-yl)ethanamine?
The IUPAC name of N-ethyl-N-methyl-2-(1-propan-2-ylpiperidin-4-yl)ethanamine (CID 176717350) is N-ethyl-N-methyl-2-(1-propan-2-ylpiperidin-4-yl)ethanamine.
What is the SMILES notation for N-ethyl-N-methyl-2-(1-propan-2-ylpiperidin-4-yl)ethanamine?
The canonical SMILES for N-ethyl-N-methyl-2-(1-propan-2-ylpiperidin-4-yl)ethanamine is CCN(C)CCC1CCN(C(C)C)CC1.
What is the InChIKey of N-ethyl-N-methyl-2-(1-propan-2-ylpiperidin-4-yl)ethanamine?
The InChIKey is MNILSYZLXILTBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2/c1-5-14(4)9-6-13-7-10-15(11-8-13)12(2)3/h12-13H,5-11H2,1-4H3.
What are the key properties of N-ethyl-N-methyl-2-(1-propan-2-ylpiperidin-4-yl)ethanamine?
N-ethyl-N-methyl-2-(1-propan-2-ylpiperidin-4-yl)ethanamine has a molecular weight of 212.38 g/mol, XLogP of 2.45, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-methyl-2-(1-propan-2-ylpiperidin-4-yl)ethanamine is sourced from PubChem (CID 176717350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).