[1-(1-methylpyrazol-3-yl)piperidin-3-yl]methanamine

C10H18N4 — CID 112708877

IUPAC[1-(1-methylpyrazol-3-yl)piperidin-3-yl]methanamine
SMILESCn1ccc(N2CCCC(CN)C2)n1
InChIInChI=1S/C10H18N4/c1-13-6-4-10(12-13)14-5-2-3-9(7-11)8-14/h4,6,9H,2-3,5,7-8,11H2,1H3
InChIKeyIFARZSBIFDDIMY-UHFFFAOYSA-N
MW194.28 g/mol
LogP0.60
Rot. Bonds2

About [1-(1-methylpyrazol-3-yl)piperidin-3-yl]methanamine

[1-(1-methylpyrazol-3-yl)piperidin-3-yl]methanamine (PubChem CID 112708877) has the molecular formula C10H18N4 and a molecular weight of 194.28 g/mol. Its IUPAC name is [1-(1-methylpyrazol-3-yl)piperidin-3-yl]methanamine.

Molecular Properties

Compound Name[1-(1-methylpyrazol-3-yl)piperidin-3-yl]methanamine
PubChem CID112708877
Molecular FormulaC10H18N4
Molecular Weight194.28 g/mol
Exact Mass194.15
IUPAC Name[1-(1-methylpyrazol-3-yl)piperidin-3-yl]methanamine
SMILESCn1ccc(N2CCCC(CN)C2)n1
InChIInChI=1S/C10H18N4/c1-13-6-4-10(12-13)14-5-2-3-9(7-11)8-14/h4,6,9H,2-3,5,7-8,11H2,1H3
InChIKeyIFARZSBIFDDIMY-UHFFFAOYSA-N
XLogP0.60
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 50.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(1-methylpyrazol-3-yl)piperidin-4-amine
CID 79779084
[1-(1-methylimidazol-2-yl)piperidin-3-yl]methanamine
CID 62132389
[1-[3-(trifluoromethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]piperidin-3-yl]methanamine
CID 106950587
N-[1-(1-methylpyrazol-3-yl)piperidin-3-yl]acetamide
CID 145270654
6-[3-(aminomethyl)piperidin-1-yl]-2H-[1,2,4]triazolo[4,3-b]pyridazin-3-one
CID 66283978
1-(1-methylpyrazol-3-yl)-N-propan-2-ylpyrrolidin-3-amine
CID 79786962
[1-(1-propan-2-ylimidazol-2-yl)piperidin-3-yl]methanamine
CID 106552327
N,3-dimethyl-1-(1-methylpyrazol-3-yl)piperidin-4-amine
CID 79779493
(1-pyridin-3-ylpiperidin-3-yl)methanamine
CID 83818099
N-methyl-1-(1-methylpyrazol-3-yl)piperidin-4-amine
CID 79779593
[(3R)-1-(6-methylpyridazin-3-yl)pyrrolidin-3-yl]methanamine
CID 94342238
[1-(6-pyridin-2-ylpyridazin-3-yl)piperidin-3-yl]methanamine
CID 116972449

Frequently Asked Questions

What is the IUPAC name of [1-(1-methylpyrazol-3-yl)piperidin-3-yl]methanamine?
The IUPAC name of [1-(1-methylpyrazol-3-yl)piperidin-3-yl]methanamine (CID 112708877) is [1-(1-methylpyrazol-3-yl)piperidin-3-yl]methanamine.
What is the SMILES notation for [1-(1-methylpyrazol-3-yl)piperidin-3-yl]methanamine?
The canonical SMILES for [1-(1-methylpyrazol-3-yl)piperidin-3-yl]methanamine is Cn1ccc(N2CCCC(CN)C2)n1.
What is the InChIKey of [1-(1-methylpyrazol-3-yl)piperidin-3-yl]methanamine?
The InChIKey is IFARZSBIFDDIMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4/c1-13-6-4-10(12-13)14-5-2-3-9(7-11)8-14/h4,6,9H,2-3,5,7-8,11H2,1H3.
What are the key properties of [1-(1-methylpyrazol-3-yl)piperidin-3-yl]methanamine?
[1-(1-methylpyrazol-3-yl)piperidin-3-yl]methanamine has a molecular weight of 194.28 g/mol, XLogP of 0.60, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1-methylpyrazol-3-yl)piperidin-3-yl]methanamine is sourced from PubChem (CID 112708877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).