1-[2-(2-methylpyrazol-3-yl)ethyl]piperidin-3-amine

C11H20N4 — CID 102999239

IUPAC1-[2-(2-methylpyrazol-3-yl)ethyl]piperidin-3-amine
SMILESCn1nccc1CCN1CCCC(N)C1
InChIInChI=1S/C11H20N4/c1-14-11(4-6-13-14)5-8-15-7-2-3-10(12)9-15/h4,6,10H,2-3,5,7-9,12H2,1H3
InChIKeyRLVWABDMRDKEDY-UHFFFAOYSA-N
MW208.31 g/mol
LogP0.39
Rot. Bonds3

About 1-[2-(2-methylpyrazol-3-yl)ethyl]piperidin-3-amine

1-[2-(2-methylpyrazol-3-yl)ethyl]piperidin-3-amine (PubChem CID 102999239) has the molecular formula C11H20N4 and a molecular weight of 208.31 g/mol. Its IUPAC name is 1-[2-(2-methylpyrazol-3-yl)ethyl]piperidin-3-amine.

Molecular Properties

Compound Name1-[2-(2-methylpyrazol-3-yl)ethyl]piperidin-3-amine
PubChem CID102999239
Molecular FormulaC11H20N4
Molecular Weight208.31 g/mol
Exact Mass208.17
IUPAC Name1-[2-(2-methylpyrazol-3-yl)ethyl]piperidin-3-amine
SMILESCn1nccc1CCN1CCCC(N)C1
InChIInChI=1S/C11H20N4/c1-14-11(4-6-13-14)5-8-15-7-2-3-10(12)9-15/h4,6,10H,2-3,5,7-9,12H2,1H3
InChIKeyRLVWABDMRDKEDY-UHFFFAOYSA-N
XLogP0.39
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.31
LogP ≤ 50.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-methylpyrazol-3-yl)ethyl]piperidin-3-amine?
The IUPAC name of 1-[2-(2-methylpyrazol-3-yl)ethyl]piperidin-3-amine (CID 102999239) is 1-[2-(2-methylpyrazol-3-yl)ethyl]piperidin-3-amine.
What is the SMILES notation for 1-[2-(2-methylpyrazol-3-yl)ethyl]piperidin-3-amine?
The canonical SMILES for 1-[2-(2-methylpyrazol-3-yl)ethyl]piperidin-3-amine is Cn1nccc1CCN1CCCC(N)C1.
What is the InChIKey of 1-[2-(2-methylpyrazol-3-yl)ethyl]piperidin-3-amine?
The InChIKey is RLVWABDMRDKEDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4/c1-14-11(4-6-13-14)5-8-15-7-2-3-10(12)9-15/h4,6,10H,2-3,5,7-9,12H2,1H3.
What are the key properties of 1-[2-(2-methylpyrazol-3-yl)ethyl]piperidin-3-amine?
1-[2-(2-methylpyrazol-3-yl)ethyl]piperidin-3-amine has a molecular weight of 208.31 g/mol, XLogP of 0.39, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-methylpyrazol-3-yl)ethyl]piperidin-3-amine is sourced from PubChem (CID 102999239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).