N,3-dimethyl-1-(1-methylpyrazol-3-yl)piperidin-4-amine

C11H20N4 — CID 79779493

IUPACN,3-dimethyl-1-(1-methylpyrazol-3-yl)piperidin-4-amine
SMILESCNC1CCN(c2ccn(C)n2)CC1C
InChIInChI=1S/C11H20N4/c1-9-8-15(7-4-10(9)12-2)11-5-6-14(3)13-11/h5-6,9-10,12H,4,7-8H2,1-3H3
InChIKeyXAJGQWUTJXPZND-UHFFFAOYSA-N
MW208.31 g/mol
LogP0.85
Rot. Bonds2

About N,3-dimethyl-1-(1-methylpyrazol-3-yl)piperidin-4-amine

N,3-dimethyl-1-(1-methylpyrazol-3-yl)piperidin-4-amine (PubChem CID 79779493) has the molecular formula C11H20N4 and a molecular weight of 208.31 g/mol. Its IUPAC name is N,3-dimethyl-1-(1-methylpyrazol-3-yl)piperidin-4-amine.

Molecular Properties

Compound NameN,3-dimethyl-1-(1-methylpyrazol-3-yl)piperidin-4-amine
PubChem CID79779493
Molecular FormulaC11H20N4
Molecular Weight208.31 g/mol
Exact Mass208.17
IUPAC NameN,3-dimethyl-1-(1-methylpyrazol-3-yl)piperidin-4-amine
SMILESCNC1CCN(c2ccn(C)n2)CC1C
InChIInChI=1S/C11H20N4/c1-9-8-15(7-4-10(9)12-2)11-5-6-14(3)13-11/h5-6,9-10,12H,4,7-8H2,1-3H3
InChIKeyXAJGQWUTJXPZND-UHFFFAOYSA-N
XLogP0.85
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.31
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,3-dimethyl-1-(1-methylpyrazol-3-yl)piperidin-4-amine?
The IUPAC name of N,3-dimethyl-1-(1-methylpyrazol-3-yl)piperidin-4-amine (CID 79779493) is N,3-dimethyl-1-(1-methylpyrazol-3-yl)piperidin-4-amine.
What is the SMILES notation for N,3-dimethyl-1-(1-methylpyrazol-3-yl)piperidin-4-amine?
The canonical SMILES for N,3-dimethyl-1-(1-methylpyrazol-3-yl)piperidin-4-amine is CNC1CCN(c2ccn(C)n2)CC1C.
What is the InChIKey of N,3-dimethyl-1-(1-methylpyrazol-3-yl)piperidin-4-amine?
The InChIKey is XAJGQWUTJXPZND-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4/c1-9-8-15(7-4-10(9)12-2)11-5-6-14(3)13-11/h5-6,9-10,12H,4,7-8H2,1-3H3.
What are the key properties of N,3-dimethyl-1-(1-methylpyrazol-3-yl)piperidin-4-amine?
N,3-dimethyl-1-(1-methylpyrazol-3-yl)piperidin-4-amine has a molecular weight of 208.31 g/mol, XLogP of 0.85, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-dimethyl-1-(1-methylpyrazol-3-yl)piperidin-4-amine is sourced from PubChem (CID 79779493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).