2-(1-cyclopropylpyrazol-4-yl)-1-methylpiperidin-3-amine

C12H20N4 — CID 175713041

IUPAC2-(1-cyclopropylpyrazol-4-yl)-1-methylpiperidin-3-amine
SMILESCN1CCCC(N)C1c1cnn(C2CC2)c1
InChIInChI=1S/C12H20N4/c1-15-6-2-3-11(13)12(15)9-7-14-16(8-9)10-4-5-10/h7-8,10-12H,2-6,13H2,1H3
InChIKeyHPXFLSLOQOUYJU-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.31
Rot. Bonds2

About 2-(1-cyclopropylpyrazol-4-yl)-1-methylpiperidin-3-amine

2-(1-cyclopropylpyrazol-4-yl)-1-methylpiperidin-3-amine (PubChem CID 175713041) has the molecular formula C12H20N4 and a molecular weight of 220.32 g/mol. Its IUPAC name is 2-(1-cyclopropylpyrazol-4-yl)-1-methylpiperidin-3-amine.

Molecular Properties

Compound Name2-(1-cyclopropylpyrazol-4-yl)-1-methylpiperidin-3-amine
PubChem CID175713041
Molecular FormulaC12H20N4
Molecular Weight220.32 g/mol
Exact Mass220.17
IUPAC Name2-(1-cyclopropylpyrazol-4-yl)-1-methylpiperidin-3-amine
SMILESCN1CCCC(N)C1c1cnn(C2CC2)c1
InChIInChI=1S/C12H20N4/c1-15-6-2-3-11(13)12(15)9-7-14-16(8-9)10-4-5-10/h7-8,10-12H,2-6,13H2,1H3
InChIKeyHPXFLSLOQOUYJU-UHFFFAOYSA-N
XLogP1.31
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(1-cyclopropylpyrazol-4-yl)-1-methylpiperidin-3-amine?
The IUPAC name of 2-(1-cyclopropylpyrazol-4-yl)-1-methylpiperidin-3-amine (CID 175713041) is 2-(1-cyclopropylpyrazol-4-yl)-1-methylpiperidin-3-amine.
What is the SMILES notation for 2-(1-cyclopropylpyrazol-4-yl)-1-methylpiperidin-3-amine?
The canonical SMILES for 2-(1-cyclopropylpyrazol-4-yl)-1-methylpiperidin-3-amine is CN1CCCC(N)C1c1cnn(C2CC2)c1.
What is the InChIKey of 2-(1-cyclopropylpyrazol-4-yl)-1-methylpiperidin-3-amine?
The InChIKey is HPXFLSLOQOUYJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4/c1-15-6-2-3-11(13)12(15)9-7-14-16(8-9)10-4-5-10/h7-8,10-12H,2-6,13H2,1H3.
What are the key properties of 2-(1-cyclopropylpyrazol-4-yl)-1-methylpiperidin-3-amine?
2-(1-cyclopropylpyrazol-4-yl)-1-methylpiperidin-3-amine has a molecular weight of 220.32 g/mol, XLogP of 1.31, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-cyclopropylpyrazol-4-yl)-1-methylpiperidin-3-amine is sourced from PubChem (CID 175713041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).