3-[1-hydrazinyl-2-(oxan-2-yl)ethyl]pyridin-4-amine

C12H20N4O — CID 105267384

IUPAC3-[1-hydrazinyl-2-(oxan-2-yl)ethyl]pyridin-4-amine
SMILESNNC(CC1CCCCO1)c1cnccc1N
InChIInChI=1S/C12H20N4O/c13-11-4-5-15-8-10(11)12(16-14)7-9-3-1-2-6-17-9/h4-5,8-9,12,16H,1-3,6-7,14H2,(H2,13,15)
InChIKeyKQBOWOBMFBOIQN-UHFFFAOYSA-N
MW236.32 g/mol
LogP1.13
Rot. Bonds4

About 3-[1-hydrazinyl-2-(oxan-2-yl)ethyl]pyridin-4-amine

3-[1-hydrazinyl-2-(oxan-2-yl)ethyl]pyridin-4-amine (PubChem CID 105267384) has the molecular formula C12H20N4O and a molecular weight of 236.32 g/mol. Its IUPAC name is 3-[1-hydrazinyl-2-(oxan-2-yl)ethyl]pyridin-4-amine.

Molecular Properties

Compound Name3-[1-hydrazinyl-2-(oxan-2-yl)ethyl]pyridin-4-amine
PubChem CID105267384
Molecular FormulaC12H20N4O
Molecular Weight236.32 g/mol
Exact Mass236.16
IUPAC Name3-[1-hydrazinyl-2-(oxan-2-yl)ethyl]pyridin-4-amine
SMILESNNC(CC1CCCCO1)c1cnccc1N
InChIInChI=1S/C12H20N4O/c13-11-4-5-15-8-10(11)12(16-14)7-9-3-1-2-6-17-9/h4-5,8-9,12,16H,1-3,6-7,14H2,(H2,13,15)
InChIKeyKQBOWOBMFBOIQN-UHFFFAOYSA-N
XLogP1.13
TPSA86.19 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 51.13
H-Bond Donors ≤ 53
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

N-methyl-1-(4-methyl-3-pyridinyl)-2-(oxolan-2-yl)ethanamine
CID 66272484
[1-(2-methylphenyl)-2-(oxan-2-yl)ethyl]hydrazine
CID 105267276
5-chloro-3-[1-hydrazinyl-2-(oxan-2-yl)ethyl]pyridin-2-amine
CID 105267477
[1-(2-methoxyphenyl)-2-(oxan-2-yl)ethyl]hydrazine
CID 105267281
1-(4-methyl-3-pyridinyl)-2-(oxolan-2-yl)ethanol
CID 66271830
[2-cyclopentyl-1-(3-methyl-4-pyridinyl)ethyl]hydrazine
CID 105261770
[1-(2,4-dimethoxyphenyl)-2-(oxan-2-yl)ethyl]hydrazine
CID 105267581
[1-(1-benzothiophen-7-yl)-2-(oxan-2-yl)ethyl]hydrazine
CID 105267339
[1-(4-bromo-3-chloro-2-fluorophenyl)-2-(oxan-2-yl)ethyl]hydrazine
CID 106765387
[1-(4-methoxyphenyl)-2-(oxan-2-yl)ethyl]hydrazine
CID 105267425
[1-(2,3-difluorophenyl)-2-(oxolan-2-yl)ethyl]hydrazine
CID 105198582
[1-(3-chloro-4-pyridinyl)-4-(oxolan-2-yl)butyl]hydrazine
CID 105314132

Frequently Asked Questions

What is the IUPAC name of 3-[1-hydrazinyl-2-(oxan-2-yl)ethyl]pyridin-4-amine?
The IUPAC name of 3-[1-hydrazinyl-2-(oxan-2-yl)ethyl]pyridin-4-amine (CID 105267384) is 3-[1-hydrazinyl-2-(oxan-2-yl)ethyl]pyridin-4-amine.
What is the SMILES notation for 3-[1-hydrazinyl-2-(oxan-2-yl)ethyl]pyridin-4-amine?
The canonical SMILES for 3-[1-hydrazinyl-2-(oxan-2-yl)ethyl]pyridin-4-amine is NNC(CC1CCCCO1)c1cnccc1N.
What is the InChIKey of 3-[1-hydrazinyl-2-(oxan-2-yl)ethyl]pyridin-4-amine?
The InChIKey is KQBOWOBMFBOIQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O/c13-11-4-5-15-8-10(11)12(16-14)7-9-3-1-2-6-17-9/h4-5,8-9,12,16H,1-3,6-7,14H2,(H2,13,15).
What are the key properties of 3-[1-hydrazinyl-2-(oxan-2-yl)ethyl]pyridin-4-amine?
3-[1-hydrazinyl-2-(oxan-2-yl)ethyl]pyridin-4-amine has a molecular weight of 236.32 g/mol, XLogP of 1.13, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-hydrazinyl-2-(oxan-2-yl)ethyl]pyridin-4-amine is sourced from PubChem (CID 105267384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).