(2-hydrazinyl-3-pyridinyl)-(3-methylpiperidin-1-yl)methanone

C12H18N4O — CID 62249185

IUPAC(2-hydrazinyl-3-pyridinyl)-(3-methylpiperidin-1-yl)methanone
SMILESCC1CCCN(C(=O)c2cccnc2NN)C1
InChIInChI=1S/C12H18N4O/c1-9-4-3-7-16(8-9)12(17)10-5-2-6-14-11(10)15-13/h2,5-6,9H,3-4,7-8,13H2,1H3,(H,14,15)
InChIKeyYODXWMMREPQOSL-UHFFFAOYSA-N
MW234.30 g/mol
LogP1.24
Rot. Bonds2

About (2-hydrazinyl-3-pyridinyl)-(3-methylpiperidin-1-yl)methanone

(2-hydrazinyl-3-pyridinyl)-(3-methylpiperidin-1-yl)methanone (PubChem CID 62249185) has the molecular formula C12H18N4O and a molecular weight of 234.30 g/mol. Its IUPAC name is (2-hydrazinyl-3-pyridinyl)-(3-methylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name(2-hydrazinyl-3-pyridinyl)-(3-methylpiperidin-1-yl)methanone
PubChem CID62249185
Molecular FormulaC12H18N4O
Molecular Weight234.30 g/mol
Exact Mass234.15
IUPAC Name(2-hydrazinyl-3-pyridinyl)-(3-methylpiperidin-1-yl)methanone
SMILESCC1CCCN(C(=O)c2cccnc2NN)C1
InChIInChI=1S/C12H18N4O/c1-9-4-3-7-16(8-9)12(17)10-5-2-6-14-11(10)15-13/h2,5-6,9H,3-4,7-8,13H2,1H3,(H,14,15)
InChIKeyYODXWMMREPQOSL-UHFFFAOYSA-N
XLogP1.24
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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-(methylamino)-3-pyridinyl]-(3-methylpiperidin-1-yl)methanone
CID 62172050
(2-hydrazinyl-3-pyridinyl)-(3-hydroxypiperidin-1-yl)methanone
CID 62249880
(2-hydrazinyl-3-pyridinyl)-(2-methyl-1,4-oxazepan-4-yl)methanone
CID 62967501
(2-hydrazinyl-3-pyridinyl)-[3-(hydroxymethyl)piperidin-1-yl]methanone
CID 62234126
(3-methylpiperidin-1-yl)-[2-(propylamino)-3-pyridinyl]methanone
CID 62172051
(2-fluoro-3-pyridinyl)-(3-methylpiperidin-1-yl)methanone
CID 107358404
(2-hydrazinyl-3-pyridinyl)-(3-phenylpyrrolidin-1-yl)methanone
CID 62236169
(2-hydrazinyl-3-pyridinyl)-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)methanone
CID 79170497
(3-methylpiperidin-1-yl)-(2-piperidin-1-yl-3-pyridinyl)methanone
CID 84576155
(2-hydrazinyl-3-pyridinyl)-(4-methyl-1,4-diazepan-1-yl)methanone
CID 62234639
[(4R)-4-methylazepan-1-yl]-[2-(propan-2-ylamino)-3-pyridinyl]methanone
CID 96502046
N-(3-amino-2-pyridinyl)-3-methylpiperidine-1-carboxamide
CID 113391868

Frequently Asked Questions

What is the IUPAC name of (2-hydrazinyl-3-pyridinyl)-(3-methylpiperidin-1-yl)methanone?
The IUPAC name of (2-hydrazinyl-3-pyridinyl)-(3-methylpiperidin-1-yl)methanone (CID 62249185) is (2-hydrazinyl-3-pyridinyl)-(3-methylpiperidin-1-yl)methanone.
What is the SMILES notation for (2-hydrazinyl-3-pyridinyl)-(3-methylpiperidin-1-yl)methanone?
The canonical SMILES for (2-hydrazinyl-3-pyridinyl)-(3-methylpiperidin-1-yl)methanone is CC1CCCN(C(=O)c2cccnc2NN)C1.
What is the InChIKey of (2-hydrazinyl-3-pyridinyl)-(3-methylpiperidin-1-yl)methanone?
The InChIKey is YODXWMMREPQOSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O/c1-9-4-3-7-16(8-9)12(17)10-5-2-6-14-11(10)15-13/h2,5-6,9H,3-4,7-8,13H2,1H3,(H,14,15).
What are the key properties of (2-hydrazinyl-3-pyridinyl)-(3-methylpiperidin-1-yl)methanone?
(2-hydrazinyl-3-pyridinyl)-(3-methylpiperidin-1-yl)methanone has a molecular weight of 234.30 g/mol, XLogP of 1.24, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-hydrazinyl-3-pyridinyl)-(3-methylpiperidin-1-yl)methanone is sourced from PubChem (CID 62249185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).