1-benzyl-N-ethyl-2,2,6,6-tetramethylpiperidin-4-amine

C18H30N2 — CID 20501093

IUPAC1-benzyl-N-ethyl-2,2,6,6-tetramethylpiperidin-4-amine
SMILESCCNC1CC(C)(C)N(Cc2ccccc2)C(C)(C)C1
InChIInChI=1S/C18H30N2/c1-6-19-16-12-17(2,3)20(18(4,5)13-16)14-15-10-8-7-9-11-15/h7-11,16,19H,6,12-14H2,1-5H3
InChIKeyXIXYTRDWGKJMKR-UHFFFAOYSA-N
MW274.45 g/mol
LogP3.82
Rot. Bonds4

About 1-benzyl-N-ethyl-2,2,6,6-tetramethylpiperidin-4-amine

1-benzyl-N-ethyl-2,2,6,6-tetramethylpiperidin-4-amine (PubChem CID 20501093) has the molecular formula C18H30N2 and a molecular weight of 274.45 g/mol. Its IUPAC name is 1-benzyl-N-ethyl-2,2,6,6-tetramethylpiperidin-4-amine.

Molecular Properties

Compound Name1-benzyl-N-ethyl-2,2,6,6-tetramethylpiperidin-4-amine
PubChem CID20501093
Molecular FormulaC18H30N2
Molecular Weight274.45 g/mol
Exact Mass274.24
IUPAC Name1-benzyl-N-ethyl-2,2,6,6-tetramethylpiperidin-4-amine
SMILESCCNC1CC(C)(C)N(Cc2ccccc2)C(C)(C)C1
InChIInChI=1S/C18H30N2/c1-6-19-16-12-17(2,3)20(18(4,5)13-16)14-15-10-8-7-9-11-15/h7-11,16,19H,6,12-14H2,1-5H3
InChIKeyXIXYTRDWGKJMKR-UHFFFAOYSA-N
XLogP3.82
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.45
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-benzyl-2,2,6,6-tetramethylpiperidine-4-carbaldehyde
CID 170430014
(E)-2,3-bis(1-benzyl-2,2,6,6-tetramethylpiperidin-4-yl)but-2-enedioic acid
CID 87175148
(Z)-2,3-bis(1-benzyl-2,2,6,6-tetramethylpiperidin-4-yl)but-2-enedioic acid
CID 22496642
1-benzyl-2,2,4,6,6-pentamethylpiperidine;methyl carbamate
CID 67933670
1-benzyl-N,2,2-trimethylpiperidin-4-amine
CID 117020178
3-(1-benzyl-2,2,6,6-tetramethylpiperidin-4-yl)oxypropan-1-ol
CID 135259547
1-benzyl-2,2-dimethyl-1-azaspiro[5.5]undecan-4-ol
CID 20501054
1-benzyl-N-[(1-ethylcyclopropyl)methyl]piperidin-4-amine
CID 103735414
N-ethylcyclopropanamine;phenylmethanamine
CID 143821485
(Z)-2-(1-benzyl-2,2,6,6-tetramethylpiperidin-4-yl)but-2-enedioate
CID 22507419
bis(1-benzyl-2,2,6,6-tetramethylpiperidin-4-yl) (1S,4R)-bicyclo[2.2.1]heptane-2,3-dicarboxylate
CID 54571692
1-benzyl-N-[(1-ethylcyclobutyl)methyl]piperidin-4-amine
CID 103741195

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-N-ethyl-2,2,6,6-tetramethylpiperidin-4-amine?
The IUPAC name of 1-benzyl-N-ethyl-2,2,6,6-tetramethylpiperidin-4-amine (CID 20501093) is 1-benzyl-N-ethyl-2,2,6,6-tetramethylpiperidin-4-amine.
What is the SMILES notation for 1-benzyl-N-ethyl-2,2,6,6-tetramethylpiperidin-4-amine?
The canonical SMILES for 1-benzyl-N-ethyl-2,2,6,6-tetramethylpiperidin-4-amine is CCNC1CC(C)(C)N(Cc2ccccc2)C(C)(C)C1.
What is the InChIKey of 1-benzyl-N-ethyl-2,2,6,6-tetramethylpiperidin-4-amine?
The InChIKey is XIXYTRDWGKJMKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2/c1-6-19-16-12-17(2,3)20(18(4,5)13-16)14-15-10-8-7-9-11-15/h7-11,16,19H,6,12-14H2,1-5H3.
What are the key properties of 1-benzyl-N-ethyl-2,2,6,6-tetramethylpiperidin-4-amine?
1-benzyl-N-ethyl-2,2,6,6-tetramethylpiperidin-4-amine has a molecular weight of 274.45 g/mol, XLogP of 3.82, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-N-ethyl-2,2,6,6-tetramethylpiperidin-4-amine is sourced from PubChem (CID 20501093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).