[1-(6-hydrazinyl-4-nitro-2-pyridinyl)piperidin-4-yl]methanol

C11H17N5O3 — CID 114071494

IUPAC[1-(6-hydrazinyl-4-nitro-2-pyridinyl)piperidin-4-yl]methanol
SMILESNNc1cc([N+](=O)[O-])cc(N2CCC(CO)CC2)n1
InChIInChI=1S/C11H17N5O3/c12-14-10-5-9(16(18)19)6-11(13-10)15-3-1-8(7-17)2-4-15/h5-6,8,17H,1-4,7,12H2,(H,13,14)
InChIKeyAOSCOFWNOBRRRT-UHFFFAOYSA-N
MW267.29 g/mol
LogP0.48
Rot. Bonds4

About [1-(6-hydrazinyl-4-nitro-2-pyridinyl)piperidin-4-yl]methanol

[1-(6-hydrazinyl-4-nitro-2-pyridinyl)piperidin-4-yl]methanol (PubChem CID 114071494) has the molecular formula C11H17N5O3 and a molecular weight of 267.29 g/mol. Its IUPAC name is [1-(6-hydrazinyl-4-nitro-2-pyridinyl)piperidin-4-yl]methanol.

Molecular Properties

Compound Name[1-(6-hydrazinyl-4-nitro-2-pyridinyl)piperidin-4-yl]methanol
PubChem CID114071494
Molecular FormulaC11H17N5O3
Molecular Weight267.29 g/mol
Exact Mass267.13
IUPAC Name[1-(6-hydrazinyl-4-nitro-2-pyridinyl)piperidin-4-yl]methanol
SMILESNNc1cc([N+](=O)[O-])cc(N2CCC(CO)CC2)n1
InChIInChI=1S/C11H17N5O3/c12-14-10-5-9(16(18)19)6-11(13-10)15-3-1-8(7-17)2-4-15/h5-6,8,17H,1-4,7,12H2,(H,13,14)
InChIKeyAOSCOFWNOBRRRT-UHFFFAOYSA-N
XLogP0.48
TPSA117.55 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.29
LogP ≤ 50.48
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Related Compounds

[6-(4-methyl-1,4-diazepan-1-yl)-4-nitro-2-pyridinyl]hydrazine
CID 114071527
[6-(2-ethyl-1,4-oxazepan-4-yl)-4-nitro-2-pyridinyl]hydrazine
CID 114218872
[1-(2,6-dichloro-4-nitrophenyl)piperidin-4-yl]methanol
CID 103952600
[1-(6-nitroquinoxalin-2-yl)piperidin-4-yl]methanol
CID 71650059
[1-(3-methyl-5-nitrophenyl)piperidin-4-yl]methanol
CID 112649607
[1-(2-ethyl-6-hydrazinylpyrimidin-4-yl)pyrrolidin-3-yl]methanol
CID 112629749
[1-(6-hydrazinyl-2-methylsulfanylpyrimidin-4-yl)pyrrolidin-3-yl]methanol
CID 112629757
[1-(6-nitro-1,3-benzothiazol-2-yl)piperidin-4-yl]methanol
CID 97290130
[1-[2-(2-aminoethyl)-4-nitrophenyl]piperidin-4-yl]methanol
CID 170868844
[1-[3-(methylamino)-5-nitrophenyl]pyrrolidin-3-yl]methanol
CID 112629547
[1-(5-nitro-2-pyridinyl)pyrrolidin-3-yl]methanol
CID 62371884
[1-(4-nitrophenyl)pyrrolidin-3-yl]methanol
CID 62370454

Frequently Asked Questions

What is the IUPAC name of [1-(6-hydrazinyl-4-nitro-2-pyridinyl)piperidin-4-yl]methanol?
The IUPAC name of [1-(6-hydrazinyl-4-nitro-2-pyridinyl)piperidin-4-yl]methanol (CID 114071494) is [1-(6-hydrazinyl-4-nitro-2-pyridinyl)piperidin-4-yl]methanol.
What is the SMILES notation for [1-(6-hydrazinyl-4-nitro-2-pyridinyl)piperidin-4-yl]methanol?
The canonical SMILES for [1-(6-hydrazinyl-4-nitro-2-pyridinyl)piperidin-4-yl]methanol is NNc1cc([N+](=O)[O-])cc(N2CCC(CO)CC2)n1.
What is the InChIKey of [1-(6-hydrazinyl-4-nitro-2-pyridinyl)piperidin-4-yl]methanol?
The InChIKey is AOSCOFWNOBRRRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N5O3/c12-14-10-5-9(16(18)19)6-11(13-10)15-3-1-8(7-17)2-4-15/h5-6,8,17H,1-4,7,12H2,(H,13,14).
What are the key properties of [1-(6-hydrazinyl-4-nitro-2-pyridinyl)piperidin-4-yl]methanol?
[1-(6-hydrazinyl-4-nitro-2-pyridinyl)piperidin-4-yl]methanol has a molecular weight of 267.29 g/mol, XLogP of 0.48, 4 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(6-hydrazinyl-4-nitro-2-pyridinyl)piperidin-4-yl]methanol is sourced from PubChem (CID 114071494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).