2-(4,4-diethylpiperidin-1-yl)-2-(1-methylpyrazol-4-yl)ethanamine

C15H28N4 — CID 63157076

IUPAC2-(4,4-diethylpiperidin-1-yl)-2-(1-methylpyrazol-4-yl)ethanamine
SMILESCCC1(CC)CCN(C(CN)c2cnn(C)c2)CC1
InChIInChI=1S/C15H28N4/c1-4-15(5-2)6-8-19(9-7-15)14(10-16)13-11-17-18(3)12-13/h11-12,14H,4-10,16H2,1-3H3
InChIKeyLYIIYDANSINUTP-UHFFFAOYSA-N
MW264.42 g/mol
LogP2.32
Rot. Bonds5

About 2-(4,4-diethylpiperidin-1-yl)-2-(1-methylpyrazol-4-yl)ethanamine

2-(4,4-diethylpiperidin-1-yl)-2-(1-methylpyrazol-4-yl)ethanamine (PubChem CID 63157076) has the molecular formula C15H28N4 and a molecular weight of 264.42 g/mol. Its IUPAC name is 2-(4,4-diethylpiperidin-1-yl)-2-(1-methylpyrazol-4-yl)ethanamine.

Molecular Properties

Compound Name2-(4,4-diethylpiperidin-1-yl)-2-(1-methylpyrazol-4-yl)ethanamine
PubChem CID63157076
Molecular FormulaC15H28N4
Molecular Weight264.42 g/mol
Exact Mass264.23
IUPAC Name2-(4,4-diethylpiperidin-1-yl)-2-(1-methylpyrazol-4-yl)ethanamine
SMILESCCC1(CC)CCN(C(CN)c2cnn(C)c2)CC1
InChIInChI=1S/C15H28N4/c1-4-15(5-2)6-8-19(9-7-15)14(10-16)13-11-17-18(3)12-13/h11-12,14H,4-10,16H2,1-3H3
InChIKeyLYIIYDANSINUTP-UHFFFAOYSA-N
XLogP2.32
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.42
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[1-[2-amino-1-(1-methylpyrazol-4-yl)ethyl]pyrrolidin-3-yl]ethanol
CID 112624618
2-[2-amino-1-(1-methylpyrazol-4-yl)ethyl]-1,3,4,5,6,7,8,8a-octahydroisoquinolin-4a-ol
CID 81096185
2-amino-1-(4,4-diethylpiperidin-1-yl)-2-(1-methylpyrazol-4-yl)ethanone
CID 115290675
[4-[2-amino-1-(1-methylpyrazol-4-yl)ethyl]morpholin-2-yl]methanol
CID 81206453
2-(3,3-dimethylpiperidin-1-yl)-2-(1-propylpyrazol-4-yl)ethanamine
CID 103571894
2-(4,4-diethylpiperidin-1-yl)-2-(furan-2-yl)ethanamine
CID 63156988
2-(3,3-dimethylpiperidin-1-yl)-2-(1-ethylpyrazol-4-yl)ethanamine
CID 103569630
2-(1-ethylpyrazol-4-yl)-2-(4-methoxypiperidin-1-yl)ethanamine
CID 103569451
(1R)-1-(1-methylpyrazol-4-yl)ethane-1,2-diamine
CID 93094324
2-(3,3-diethylpyrrolidin-1-yl)-2-(6-methoxy-3-pyridinyl)ethanamine
CID 114937246
2-(1-ethylpyrazol-4-yl)-2-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)ethanamine
CID 103569678
2-(4-cyclopropylpiperazin-1-yl)-2-(1-propylpyrazol-4-yl)ethanamine
CID 103571785

Frequently Asked Questions

What is the IUPAC name of 2-(4,4-diethylpiperidin-1-yl)-2-(1-methylpyrazol-4-yl)ethanamine?
The IUPAC name of 2-(4,4-diethylpiperidin-1-yl)-2-(1-methylpyrazol-4-yl)ethanamine (CID 63157076) is 2-(4,4-diethylpiperidin-1-yl)-2-(1-methylpyrazol-4-yl)ethanamine.
What is the SMILES notation for 2-(4,4-diethylpiperidin-1-yl)-2-(1-methylpyrazol-4-yl)ethanamine?
The canonical SMILES for 2-(4,4-diethylpiperidin-1-yl)-2-(1-methylpyrazol-4-yl)ethanamine is CCC1(CC)CCN(C(CN)c2cnn(C)c2)CC1.
What is the InChIKey of 2-(4,4-diethylpiperidin-1-yl)-2-(1-methylpyrazol-4-yl)ethanamine?
The InChIKey is LYIIYDANSINUTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4/c1-4-15(5-2)6-8-19(9-7-15)14(10-16)13-11-17-18(3)12-13/h11-12,14H,4-10,16H2,1-3H3.
What are the key properties of 2-(4,4-diethylpiperidin-1-yl)-2-(1-methylpyrazol-4-yl)ethanamine?
2-(4,4-diethylpiperidin-1-yl)-2-(1-methylpyrazol-4-yl)ethanamine has a molecular weight of 264.42 g/mol, XLogP of 2.32, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,4-diethylpiperidin-1-yl)-2-(1-methylpyrazol-4-yl)ethanamine is sourced from PubChem (CID 63157076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).