N-[1-(1,3-dimethylpyrazol-4-yl)ethyl]-2,6-dimethylpiperidin-1-amine

C14H26N4 — CID 83009856

IUPACN-[1-(1,3-dimethylpyrazol-4-yl)ethyl]-2,6-dimethylpiperidin-1-amine
SMILESCc1nn(C)cc1C(C)NN1C(C)CCCC1C
InChIInChI=1S/C14H26N4/c1-10-7-6-8-11(2)18(10)16-13(4)14-9-17(5)15-12(14)3/h9-11,13,16H,6-8H2,1-5H3
InChIKeyCZUBKBXJNPLIQV-UHFFFAOYSA-N
MW250.39 g/mol
LogP2.56
Rot. Bonds3

About N-[1-(1,3-dimethylpyrazol-4-yl)ethyl]-2,6-dimethylpiperidin-1-amine

N-[1-(1,3-dimethylpyrazol-4-yl)ethyl]-2,6-dimethylpiperidin-1-amine (PubChem CID 83009856) has the molecular formula C14H26N4 and a molecular weight of 250.39 g/mol. Its IUPAC name is N-[1-(1,3-dimethylpyrazol-4-yl)ethyl]-2,6-dimethylpiperidin-1-amine.

Molecular Properties

Compound NameN-[1-(1,3-dimethylpyrazol-4-yl)ethyl]-2,6-dimethylpiperidin-1-amine
PubChem CID83009856
Molecular FormulaC14H26N4
Molecular Weight250.39 g/mol
Exact Mass250.22
IUPAC NameN-[1-(1,3-dimethylpyrazol-4-yl)ethyl]-2,6-dimethylpiperidin-1-amine
SMILESCc1nn(C)cc1C(C)NN1C(C)CCCC1C
InChIInChI=1S/C14H26N4/c1-10-7-6-8-11(2)18(10)16-13(4)14-9-17(5)15-12(14)3/h9-11,13,16H,6-8H2,1-5H3
InChIKeyCZUBKBXJNPLIQV-UHFFFAOYSA-N
XLogP2.56
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[1-(1,3-dimethylpyrazol-4-yl)ethyl]-2,6-dimethylpiperidin-1-amine?
The IUPAC name of N-[1-(1,3-dimethylpyrazol-4-yl)ethyl]-2,6-dimethylpiperidin-1-amine (CID 83009856) is N-[1-(1,3-dimethylpyrazol-4-yl)ethyl]-2,6-dimethylpiperidin-1-amine.
What is the SMILES notation for N-[1-(1,3-dimethylpyrazol-4-yl)ethyl]-2,6-dimethylpiperidin-1-amine?
The canonical SMILES for N-[1-(1,3-dimethylpyrazol-4-yl)ethyl]-2,6-dimethylpiperidin-1-amine is Cc1nn(C)cc1C(C)NN1C(C)CCCC1C.
What is the InChIKey of N-[1-(1,3-dimethylpyrazol-4-yl)ethyl]-2,6-dimethylpiperidin-1-amine?
The InChIKey is CZUBKBXJNPLIQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4/c1-10-7-6-8-11(2)18(10)16-13(4)14-9-17(5)15-12(14)3/h9-11,13,16H,6-8H2,1-5H3.
What are the key properties of N-[1-(1,3-dimethylpyrazol-4-yl)ethyl]-2,6-dimethylpiperidin-1-amine?
N-[1-(1,3-dimethylpyrazol-4-yl)ethyl]-2,6-dimethylpiperidin-1-amine has a molecular weight of 250.39 g/mol, XLogP of 2.56, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(1,3-dimethylpyrazol-4-yl)ethyl]-2,6-dimethylpiperidin-1-amine is sourced from PubChem (CID 83009856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).