4-[hydrazinyl(1-oxaspiro[5.5]undecan-4-yl)methyl]-1-methylpyrazol-5-amine

C15H27N5O — CID 105230964

IUPAC4-[hydrazinyl(1-oxaspiro[5.5]undecan-4-yl)methyl]-1-methylpyrazol-5-amine
SMILESCn1ncc(C(NN)C2CCOC3(CCCCC3)C2)c1N
InChIInChI=1S/C15H27N5O/c1-20-14(16)12(10-18-20)13(19-17)11-5-8-21-15(9-11)6-3-2-4-7-15/h10-11,13,19H,2-9,16-17H2,1H3
InChIKeyYWUYOXRCOCJADC-UHFFFAOYSA-N
MW293.41 g/mol
LogP1.64
Rot. Bonds3

About 4-[hydrazinyl(1-oxaspiro[5.5]undecan-4-yl)methyl]-1-methylpyrazol-5-amine

4-[hydrazinyl(1-oxaspiro[5.5]undecan-4-yl)methyl]-1-methylpyrazol-5-amine (PubChem CID 105230964) has the molecular formula C15H27N5O and a molecular weight of 293.41 g/mol. Its IUPAC name is 4-[hydrazinyl(1-oxaspiro[5.5]undecan-4-yl)methyl]-1-methylpyrazol-5-amine.

Molecular Properties

Compound Name4-[hydrazinyl(1-oxaspiro[5.5]undecan-4-yl)methyl]-1-methylpyrazol-5-amine
PubChem CID105230964
Molecular FormulaC15H27N5O
Molecular Weight293.41 g/mol
Exact Mass293.22
IUPAC Name4-[hydrazinyl(1-oxaspiro[5.5]undecan-4-yl)methyl]-1-methylpyrazol-5-amine
SMILESCn1ncc(C(NN)C2CCOC3(CCCCC3)C2)c1N
InChIInChI=1S/C15H27N5O/c1-20-14(16)12(10-18-20)13(19-17)11-5-8-21-15(9-11)6-3-2-4-7-15/h10-11,13,19H,2-9,16-17H2,1H3
InChIKeyYWUYOXRCOCJADC-UHFFFAOYSA-N
XLogP1.64
TPSA91.12 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.41
LogP ≤ 51.64
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[(2-methylpyrazol-3-yl)-(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine
CID 105322157
2-[hydrazinyl(1-oxaspiro[5.5]undecan-4-yl)methyl]aniline
CID 105223968
[(4-methyl-3-pyridinyl)-(6-oxaspiro[4.5]decan-9-yl)methyl]hydrazine
CID 105279930
(1,5-dimethylpyrazol-4-yl)-(6-oxaspiro[4.5]decan-9-yl)methanamine
CID 105170198
[(2,5-dimethylpyrazol-3-yl)-(6-oxaspiro[4.5]decan-9-yl)methyl]hydrazine
CID 105325481
4-[(3,5-dimethylcyclohexyl)-hydrazinylmethyl]-1-methylpyrazol-5-amine
CID 105230921
4-[1,9-dioxaspiro[5.5]undecan-4-yl(hydrazinyl)methyl]-1H-pyrazol-5-amine
CID 105231085
[(1,5-dimethylpyrazol-4-yl)-(oxolan-3-yl)methyl]hydrazine
CID 105306569
[(4-methyl-2-pyridinyl)-(1-oxaspiro[5.5]undecan-4-yl)methyl]hydrazine
CID 105220110
[(5-methylfuran-2-yl)-(1-oxaspiro[5.5]undecan-4-yl)methyl]hydrazine
CID 105325208
[furan-3-yl(1-oxaspiro[5.5]undecan-4-yl)methyl]hydrazine
CID 105221431
[(4-fluoro-2-methylphenyl)-(6-oxaspiro[4.5]decan-9-yl)methyl]hydrazine
CID 105256747

Frequently Asked Questions

What is the IUPAC name of 4-[hydrazinyl(1-oxaspiro[5.5]undecan-4-yl)methyl]-1-methylpyrazol-5-amine?
The IUPAC name of 4-[hydrazinyl(1-oxaspiro[5.5]undecan-4-yl)methyl]-1-methylpyrazol-5-amine (CID 105230964) is 4-[hydrazinyl(1-oxaspiro[5.5]undecan-4-yl)methyl]-1-methylpyrazol-5-amine.
What is the SMILES notation for 4-[hydrazinyl(1-oxaspiro[5.5]undecan-4-yl)methyl]-1-methylpyrazol-5-amine?
The canonical SMILES for 4-[hydrazinyl(1-oxaspiro[5.5]undecan-4-yl)methyl]-1-methylpyrazol-5-amine is Cn1ncc(C(NN)C2CCOC3(CCCCC3)C2)c1N.
What is the InChIKey of 4-[hydrazinyl(1-oxaspiro[5.5]undecan-4-yl)methyl]-1-methylpyrazol-5-amine?
The InChIKey is YWUYOXRCOCJADC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N5O/c1-20-14(16)12(10-18-20)13(19-17)11-5-8-21-15(9-11)6-3-2-4-7-15/h10-11,13,19H,2-9,16-17H2,1H3.
What are the key properties of 4-[hydrazinyl(1-oxaspiro[5.5]undecan-4-yl)methyl]-1-methylpyrazol-5-amine?
4-[hydrazinyl(1-oxaspiro[5.5]undecan-4-yl)methyl]-1-methylpyrazol-5-amine has a molecular weight of 293.41 g/mol, XLogP of 1.64, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[hydrazinyl(1-oxaspiro[5.5]undecan-4-yl)methyl]-1-methylpyrazol-5-amine is sourced from PubChem (CID 105230964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).