1-ethyl-N-methyl-N-(3-methylbutyl)piperidin-3-amine

C13H28N2 — CID 145194103

IUPAC1-ethyl-N-methyl-N-(3-methylbutyl)piperidin-3-amine
SMILESCCN1CCCC(N(C)CCC(C)C)C1
InChIInChI=1S/C13H28N2/c1-5-15-9-6-7-13(11-15)14(4)10-8-12(2)3/h12-13H,5-11H2,1-4H3
InChIKeyOZOSACQYMJIMDN-UHFFFAOYSA-N
MW212.38 g/mol
LogP2.45
Rot. Bonds5

About 1-ethyl-N-methyl-N-(3-methylbutyl)piperidin-3-amine

1-ethyl-N-methyl-N-(3-methylbutyl)piperidin-3-amine (PubChem CID 145194103) has the molecular formula C13H28N2 and a molecular weight of 212.38 g/mol. Its IUPAC name is 1-ethyl-N-methyl-N-(3-methylbutyl)piperidin-3-amine.

Molecular Properties

Compound Name1-ethyl-N-methyl-N-(3-methylbutyl)piperidin-3-amine
PubChem CID145194103
Molecular FormulaC13H28N2
Molecular Weight212.38 g/mol
Exact Mass212.23
IUPAC Name1-ethyl-N-methyl-N-(3-methylbutyl)piperidin-3-amine
SMILESCCN1CCCC(N(C)CCC(C)C)C1
InChIInChI=1S/C13H28N2/c1-5-15-9-6-7-13(11-15)14(4)10-8-12(2)3/h12-13H,5-11H2,1-4H3
InChIKeyOZOSACQYMJIMDN-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

(3R)-1-ethyl-N,N-dimethylpiperidin-3-amine
CID 95912118
1-N-methyl-1-N-(1-methylpiperidin-3-yl)-3-N-propylbutane-1,3-diamine
CID 62546063
N'-methyl-N-(5-methylhexan-2-yl)-N'-(1-methylpiperidin-3-yl)ethane-1,2-diamine
CID 62560698
1-ethyl-N-methyl-N-(2-piperazin-1-ylethyl)azepan-4-amine
CID 65077785
4-[methyl(3-methylbutyl)amino]piperidine-1-carbothioamide
CID 157028554
(3R)-N-ethyl-N-methyl-1-propan-2-ylpiperidin-3-amine
CID 164856684
3-[methyl-[1-(3-methylbutyl)pyrrolidin-3-yl]amino]propanoic acid
CID 117004327
3,3-difluoro-N-methyl-N-(3-methylbutyl)cyclobutan-1-amine
CID 178026396
ethanol;N-methyl-N-(3-methylbutyl)oxan-4-amine
CID 144600556
ethane;N-methyl-N-(3-methylbutyl)azetidin-3-amine
CID 163376293
1,3-bis(2-methylpropyl)piperidine;1-ethyl-3-(2-methylpropyl)piperidine
CID 169241986
N-ethyl-N-methyl-1-(3-methylbutyl)piperidin-4-amine
CID 155404879

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-methyl-N-(3-methylbutyl)piperidin-3-amine?
The IUPAC name of 1-ethyl-N-methyl-N-(3-methylbutyl)piperidin-3-amine (CID 145194103) is 1-ethyl-N-methyl-N-(3-methylbutyl)piperidin-3-amine.
What is the SMILES notation for 1-ethyl-N-methyl-N-(3-methylbutyl)piperidin-3-amine?
The canonical SMILES for 1-ethyl-N-methyl-N-(3-methylbutyl)piperidin-3-amine is CCN1CCCC(N(C)CCC(C)C)C1.
What is the InChIKey of 1-ethyl-N-methyl-N-(3-methylbutyl)piperidin-3-amine?
The InChIKey is OZOSACQYMJIMDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2/c1-5-15-9-6-7-13(11-15)14(4)10-8-12(2)3/h12-13H,5-11H2,1-4H3.
What are the key properties of 1-ethyl-N-methyl-N-(3-methylbutyl)piperidin-3-amine?
1-ethyl-N-methyl-N-(3-methylbutyl)piperidin-3-amine 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 1-ethyl-N-methyl-N-(3-methylbutyl)piperidin-3-amine is sourced from PubChem (CID 145194103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).