(6-hydrazinyl-3-pyridinyl)-[4-(2-methylpropyl)piperazin-1-yl]methanone

C14H23N5O — CID 62777869

IUPAC(6-hydrazinyl-3-pyridinyl)-[4-(2-methylpropyl)piperazin-1-yl]methanone
SMILESCC(C)CN1CCN(C(=O)c2ccc(NN)nc2)CC1
InChIInChI=1S/C14H23N5O/c1-11(2)10-18-5-7-19(8-6-18)14(20)12-3-4-13(17-15)16-9-12/h3-4,9,11H,5-8,10,15H2,1-2H3,(H,16,17)
InChIKeyHNZNBADIABGFQG-UHFFFAOYSA-N
MW277.37 g/mol
LogP0.78
Rot. Bonds4

About (6-hydrazinyl-3-pyridinyl)-[4-(2-methylpropyl)piperazin-1-yl]methanone

(6-hydrazinyl-3-pyridinyl)-[4-(2-methylpropyl)piperazin-1-yl]methanone (PubChem CID 62777869) has the molecular formula C14H23N5O and a molecular weight of 277.37 g/mol. Its IUPAC name is (6-hydrazinyl-3-pyridinyl)-[4-(2-methylpropyl)piperazin-1-yl]methanone.

Molecular Properties

Compound Name(6-hydrazinyl-3-pyridinyl)-[4-(2-methylpropyl)piperazin-1-yl]methanone
PubChem CID62777869
Molecular FormulaC14H23N5O
Molecular Weight277.37 g/mol
Exact Mass277.19
IUPAC Name(6-hydrazinyl-3-pyridinyl)-[4-(2-methylpropyl)piperazin-1-yl]methanone
SMILESCC(C)CN1CCN(C(=O)c2ccc(NN)nc2)CC1
InChIInChI=1S/C14H23N5O/c1-11(2)10-18-5-7-19(8-6-18)14(20)12-3-4-13(17-15)16-9-12/h3-4,9,11H,5-8,10,15H2,1-2H3,(H,16,17)
InChIKeyHNZNBADIABGFQG-UHFFFAOYSA-N
XLogP0.78
TPSA74.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 50.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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

(6-fluoro-3-pyridinyl)-[4-(2-methylpropyl)piperazin-1-yl]methanone
CID 63979723
(4-hydroxyphenyl)-[4-(2-methylpropyl)piperazin-1-yl]methanone
CID 4740722
[4-(2-methylpropyl)piperazin-1-yl]-pyridin-3-ylmethanone
CID 60590538
(3,5-dimethylpiperidin-1-yl)-(6-hydrazinyl-3-pyridinyl)methanone
CID 62247413
(6-hydrazinyl-3-pyridinyl)-(3-methylpyrrolidin-1-yl)methanone
CID 62237527
6-hydrazinyl-N-(2-methyl-3-pyrrolidin-1-ylpropyl)pyridine-3-carboxamide
CID 62990482
[4-(aminomethyl)phenyl]-[4-(2-methylpropyl)piperazin-1-yl]methanone;dihydrochloride
CID 119831579
(6-hydrazinyl-3-pyridinyl)-(1,4-oxazepan-4-yl)methanone
CID 62968732
(6-hydrazinyl-3-pyridinyl)-(2,2,6,6-tetramethylmorpholin-4-yl)methanone
CID 102745686
(4-ethylpiperazin-1-yl)-[6-(propylamino)-3-pyridinyl]methanone
CID 62172305
(4-benzylpiperazin-1-yl)-[6-(3-methylbutylamino)-3-pyridinyl]methanone
CID 109159553
4-(6-hydrazinylpyridine-3-carbonyl)piperazine-2,6-dione
CID 66061854

Frequently Asked Questions

What is the IUPAC name of (6-hydrazinyl-3-pyridinyl)-[4-(2-methylpropyl)piperazin-1-yl]methanone?
The IUPAC name of (6-hydrazinyl-3-pyridinyl)-[4-(2-methylpropyl)piperazin-1-yl]methanone (CID 62777869) is (6-hydrazinyl-3-pyridinyl)-[4-(2-methylpropyl)piperazin-1-yl]methanone.
What is the SMILES notation for (6-hydrazinyl-3-pyridinyl)-[4-(2-methylpropyl)piperazin-1-yl]methanone?
The canonical SMILES for (6-hydrazinyl-3-pyridinyl)-[4-(2-methylpropyl)piperazin-1-yl]methanone is CC(C)CN1CCN(C(=O)c2ccc(NN)nc2)CC1.
What is the InChIKey of (6-hydrazinyl-3-pyridinyl)-[4-(2-methylpropyl)piperazin-1-yl]methanone?
The InChIKey is HNZNBADIABGFQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5O/c1-11(2)10-18-5-7-19(8-6-18)14(20)12-3-4-13(17-15)16-9-12/h3-4,9,11H,5-8,10,15H2,1-2H3,(H,16,17).
What are the key properties of (6-hydrazinyl-3-pyridinyl)-[4-(2-methylpropyl)piperazin-1-yl]methanone?
(6-hydrazinyl-3-pyridinyl)-[4-(2-methylpropyl)piperazin-1-yl]methanone has a molecular weight of 277.37 g/mol, XLogP of 0.78, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (6-hydrazinyl-3-pyridinyl)-[4-(2-methylpropyl)piperazin-1-yl]methanone is sourced from PubChem (CID 62777869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).