N-[(1,3-diethylpyrazol-5-yl)methyl]piperidin-1-amine

C13H24N4 — CID 83013960

IUPACN-[(1,3-diethylpyrazol-5-yl)methyl]piperidin-1-amine
SMILESCCc1cc(CNN2CCCCC2)n(CC)n1
InChIInChI=1S/C13H24N4/c1-3-12-10-13(17(4-2)15-12)11-14-16-8-6-5-7-9-16/h10,14H,3-9,11H2,1-2H3
InChIKeyFSXMBGGBMNFDCA-UHFFFAOYSA-N
MW236.36 g/mol
LogP1.96
Rot. Bonds5

About N-[(1,3-diethylpyrazol-5-yl)methyl]piperidin-1-amine

N-[(1,3-diethylpyrazol-5-yl)methyl]piperidin-1-amine (PubChem CID 83013960) has the molecular formula C13H24N4 and a molecular weight of 236.36 g/mol. Its IUPAC name is N-[(1,3-diethylpyrazol-5-yl)methyl]piperidin-1-amine.

Molecular Properties

Compound NameN-[(1,3-diethylpyrazol-5-yl)methyl]piperidin-1-amine
PubChem CID83013960
Molecular FormulaC13H24N4
Molecular Weight236.36 g/mol
Exact Mass236.20
IUPAC NameN-[(1,3-diethylpyrazol-5-yl)methyl]piperidin-1-amine
SMILESCCc1cc(CNN2CCCCC2)n(CC)n1
InChIInChI=1S/C13H24N4/c1-3-12-10-13(17(4-2)15-12)11-14-16-8-6-5-7-9-16/h10,14H,3-9,11H2,1-2H3
InChIKeyFSXMBGGBMNFDCA-UHFFFAOYSA-N
XLogP1.96
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(1,3-diethylpyrazol-5-yl)methylamino]-2-(hydroxymethyl)propane-1,3-diol
CID 107852272
N-[(3-ethyl-1-methylpyrazol-5-yl)methyl]morpholin-4-amine
CID 83021388
N-[(2-ethyl-5-methylpyrazol-3-yl)methyl]morpholin-4-amine
CID 83020855
N-[(1,3-diethylpyrazol-5-yl)methyl]-1-(2,2-dimethylcyclopropyl)methanamine
CID 114108034
N-[(1,3-diethylpyrazol-5-yl)methyl]-3-iodopropan-1-amine
CID 114503610
1-[(1,3-diethylpyrazol-5-yl)methyl]-3,5-diethylpyrazole
CID 82699372
[4-[(1,3-diethylpyrazol-5-yl)methylamino]oxan-4-yl]methanol
CID 106297418
2-(bromomethyl)-1-[(1,3-diethylpyrazol-5-yl)methyl]azepane
CID 116638458
N-[(3-propylimidazol-4-yl)methyl]piperidin-1-amine
CID 83007579
4-bromo-N-[(1,3-diethylpyrazol-5-yl)methyl]butan-1-amine
CID 106844918
N-[(2-propylpyrazol-3-yl)methyl]piperidin-1-amine
CID 114556039
2-[1-[[(1,3-diethylpyrazol-5-yl)methylamino]methyl]cyclopropyl]ethanol
CID 114756258

Frequently Asked Questions

What is the IUPAC name of N-[(1,3-diethylpyrazol-5-yl)methyl]piperidin-1-amine?
The IUPAC name of N-[(1,3-diethylpyrazol-5-yl)methyl]piperidin-1-amine (CID 83013960) is N-[(1,3-diethylpyrazol-5-yl)methyl]piperidin-1-amine.
What is the SMILES notation for N-[(1,3-diethylpyrazol-5-yl)methyl]piperidin-1-amine?
The canonical SMILES for N-[(1,3-diethylpyrazol-5-yl)methyl]piperidin-1-amine is CCc1cc(CNN2CCCCC2)n(CC)n1.
What is the InChIKey of N-[(1,3-diethylpyrazol-5-yl)methyl]piperidin-1-amine?
The InChIKey is FSXMBGGBMNFDCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4/c1-3-12-10-13(17(4-2)15-12)11-14-16-8-6-5-7-9-16/h10,14H,3-9,11H2,1-2H3.
What are the key properties of N-[(1,3-diethylpyrazol-5-yl)methyl]piperidin-1-amine?
N-[(1,3-diethylpyrazol-5-yl)methyl]piperidin-1-amine has a molecular weight of 236.36 g/mol, XLogP of 1.96, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1,3-diethylpyrazol-5-yl)methyl]piperidin-1-amine is sourced from PubChem (CID 83013960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).