N,3-dimethyl-N-(2-piperidin-2-ylethyl)butan-1-amine

C13H28N2 — CID 61429136

IUPACN,3-dimethyl-N-(2-piperidin-2-ylethyl)butan-1-amine
SMILESCC(C)CCN(C)CCC1CCCCN1
InChIInChI=1S/C13H28N2/c1-12(2)7-10-15(3)11-8-13-6-4-5-9-14-13/h12-14H,4-11H2,1-3H3
InChIKeyXMPYYKRXYXJZJX-UHFFFAOYSA-N
MW212.38 g/mol
LogP2.50
Rot. Bonds6

About N,3-dimethyl-N-(2-piperidin-2-ylethyl)butan-1-amine

N,3-dimethyl-N-(2-piperidin-2-ylethyl)butan-1-amine (PubChem CID 61429136) has the molecular formula C13H28N2 and a molecular weight of 212.38 g/mol. Its IUPAC name is N,3-dimethyl-N-(2-piperidin-2-ylethyl)butan-1-amine.

Molecular Properties

Compound NameN,3-dimethyl-N-(2-piperidin-2-ylethyl)butan-1-amine
PubChem CID61429136
Molecular FormulaC13H28N2
Molecular Weight212.38 g/mol
Exact Mass212.23
IUPAC NameN,3-dimethyl-N-(2-piperidin-2-ylethyl)butan-1-amine
SMILESCC(C)CCN(C)CCC1CCCCN1
InChIInChI=1S/C13H28N2/c1-12(2)7-10-15(3)11-8-13-6-4-5-9-14-13/h12-14H,4-11H2,1-3H3
InChIKeyXMPYYKRXYXJZJX-UHFFFAOYSA-N
XLogP2.50
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.38
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-(3-methylbutyl)piperidine
CID 94379266
N-(2-fluoroethyl)-N-methyl-2-piperidin-2-ylethanamine
CID 80696333
N-methyl-N-(2-methylsulfanylethyl)-2-piperidin-2-ylethanamine
CID 112659937
N,N-dimethyl-2-[(2S)-piperidin-2-yl]ethanamine
CID 7019358
N,3-dimethyl-N-(2-piperidin-2-ylethyl)butane-1-sulfonamide
CID 63855870
2-[2-(3-methylbutoxy)ethyl]piperidine
CID 43149946
(2R)-2-[2-(3-methylbutoxy)ethyl]piperidine
CID 86313825
N-methyl-N-(2-methylsulfonylethyl)-2-piperidin-2-ylethanamine
CID 66273209
4-methoxy-N-methyl-N-(2-piperidin-2-ylethyl)butan-2-amine
CID 116500370
N-methyl-N-(2-piperidin-2-ylethyl)cyclohexanamine
CID 43149893
N-methyl-2-pyrrolidin-2-yl-N-(2-pyrrolidin-1-ylethyl)ethanamine
CID 63209345
N-cyclopentyl-2-[methyl(2-piperidin-2-ylethyl)amino]acetamide
CID 66271067

Frequently Asked Questions

What is the IUPAC name of N,3-dimethyl-N-(2-piperidin-2-ylethyl)butan-1-amine?
The IUPAC name of N,3-dimethyl-N-(2-piperidin-2-ylethyl)butan-1-amine (CID 61429136) is N,3-dimethyl-N-(2-piperidin-2-ylethyl)butan-1-amine.
What is the SMILES notation for N,3-dimethyl-N-(2-piperidin-2-ylethyl)butan-1-amine?
The canonical SMILES for N,3-dimethyl-N-(2-piperidin-2-ylethyl)butan-1-amine is CC(C)CCN(C)CCC1CCCCN1.
What is the InChIKey of N,3-dimethyl-N-(2-piperidin-2-ylethyl)butan-1-amine?
The InChIKey is XMPYYKRXYXJZJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2/c1-12(2)7-10-15(3)11-8-13-6-4-5-9-14-13/h12-14H,4-11H2,1-3H3.
What are the key properties of N,3-dimethyl-N-(2-piperidin-2-ylethyl)butan-1-amine?
N,3-dimethyl-N-(2-piperidin-2-ylethyl)butan-1-amine has a molecular weight of 212.38 g/mol, XLogP of 2.50, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-dimethyl-N-(2-piperidin-2-ylethyl)butan-1-amine is sourced from PubChem (CID 61429136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).