4-(4,4-diethylpiperidin-1-yl)butan-2-amine

C13H28N2 — CID 63160822

IUPAC4-(4,4-diethylpiperidin-1-yl)butan-2-amine
SMILESCCC1(CC)CCN(CCC(C)N)CC1
InChIInChI=1S/C13H28N2/c1-4-13(5-2)7-10-15(11-8-13)9-6-12(3)14/h12H,4-11,14H2,1-3H3
InChIKeyBHBDSLCCCHXTIY-UHFFFAOYSA-N
MW212.38 g/mol
LogP2.63
Rot. Bonds5

About 4-(4,4-diethylpiperidin-1-yl)butan-2-amine

4-(4,4-diethylpiperidin-1-yl)butan-2-amine (PubChem CID 63160822) has the molecular formula C13H28N2 and a molecular weight of 212.38 g/mol. Its IUPAC name is 4-(4,4-diethylpiperidin-1-yl)butan-2-amine.

Molecular Properties

Compound Name4-(4,4-diethylpiperidin-1-yl)butan-2-amine
PubChem CID63160822
Molecular FormulaC13H28N2
Molecular Weight212.38 g/mol
Exact Mass212.23
IUPAC Name4-(4,4-diethylpiperidin-1-yl)butan-2-amine
SMILESCCC1(CC)CCN(CCC(C)N)CC1
InChIInChI=1S/C13H28N2/c1-4-13(5-2)7-10-15(11-8-13)9-6-12(3)14/h12H,4-11,14H2,1-3H3
InChIKeyBHBDSLCCCHXTIY-UHFFFAOYSA-N
XLogP2.63
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.38
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4,4-diethylpiperidin-1-yl)-4,4-dimethylpentan-3-amine
CID 63160248
ethyl 4-(4,4-diethylpiperidin-1-yl)-2-(methylamino)butanoate
CID 63159042
4-(4,4-diethylpiperidin-1-yl)-2-(propan-2-ylamino)butanenitrile
CID 63159208
4,4-diethyl-1-(2-methylpropyl)piperidine;ethane
CID 154670691
7-(4,4-diethylpiperidin-1-yl)heptan-1-amine
CID 55159303
5-(4,4-dimethylpiperidin-1-yl)pentan-2-amine
CID 62935849
N-[2-(4,4-diethylpiperidin-1-yl)ethyl]-3-methylbutan-2-amine
CID 63163464
N-[2-(4,4-diethylpiperidin-1-yl)ethyl]heptan-2-amine
CID 63503790
2-[2-(4,4-diethylpiperidin-1-yl)ethoxy]propanethioamide
CID 114266241
1-(4,4-diethylpiperidin-1-yl)-4-methoxybutan-2-amine
CID 55159302
3-(4,4-diethylpiperidin-1-yl)-1-(2-fluorophenyl)propan-1-ol
CID 63160173
1-cyclopropyl-2-(4,4-diethylpiperidin-1-yl)ethanamine
CID 63913044

Frequently Asked Questions

What is the IUPAC name of 4-(4,4-diethylpiperidin-1-yl)butan-2-amine?
The IUPAC name of 4-(4,4-diethylpiperidin-1-yl)butan-2-amine (CID 63160822) is 4-(4,4-diethylpiperidin-1-yl)butan-2-amine.
What is the SMILES notation for 4-(4,4-diethylpiperidin-1-yl)butan-2-amine?
The canonical SMILES for 4-(4,4-diethylpiperidin-1-yl)butan-2-amine is CCC1(CC)CCN(CCC(C)N)CC1.
What is the InChIKey of 4-(4,4-diethylpiperidin-1-yl)butan-2-amine?
The InChIKey is BHBDSLCCCHXTIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2/c1-4-13(5-2)7-10-15(11-8-13)9-6-12(3)14/h12H,4-11,14H2,1-3H3.
What are the key properties of 4-(4,4-diethylpiperidin-1-yl)butan-2-amine?
4-(4,4-diethylpiperidin-1-yl)butan-2-amine has a molecular weight of 212.38 g/mol, XLogP of 2.63, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4,4-diethylpiperidin-1-yl)butan-2-amine is sourced from PubChem (CID 63160822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).