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

C12H19ClN4O — CID 105267477

IUPAC5-chloro-3-[1-hydrazinyl-2-(oxan-2-yl)ethyl]pyridin-2-amine
SMILESNNC(CC1CCCCO1)c1cc(Cl)cnc1N
InChIInChI=1S/C12H19ClN4O/c13-8-5-10(12(14)16-7-8)11(17-15)6-9-3-1-2-4-18-9/h5,7,9,11,17H,1-4,6,15H2,(H2,14,16)
InChIKeyUIDJAOOPBVBIGH-UHFFFAOYSA-N
MW270.76 g/mol
LogP1.78
Rot. Bonds4

About 5-chloro-3-[1-hydrazinyl-2-(oxan-2-yl)ethyl]pyridin-2-amine

5-chloro-3-[1-hydrazinyl-2-(oxan-2-yl)ethyl]pyridin-2-amine (PubChem CID 105267477) has the molecular formula C12H19ClN4O and a molecular weight of 270.76 g/mol. Its IUPAC name is 5-chloro-3-[1-hydrazinyl-2-(oxan-2-yl)ethyl]pyridin-2-amine.

Molecular Properties

Compound Name5-chloro-3-[1-hydrazinyl-2-(oxan-2-yl)ethyl]pyridin-2-amine
PubChem CID105267477
Molecular FormulaC12H19ClN4O
Molecular Weight270.76 g/mol
Exact Mass270.12
IUPAC Name5-chloro-3-[1-hydrazinyl-2-(oxan-2-yl)ethyl]pyridin-2-amine
SMILESNNC(CC1CCCCO1)c1cc(Cl)cnc1N
InChIInChI=1S/C12H19ClN4O/c13-8-5-10(12(14)16-7-8)11(17-15)6-9-3-1-2-4-18-9/h5,7,9,11,17H,1-4,6,15H2,(H2,14,16)
InChIKeyUIDJAOOPBVBIGH-UHFFFAOYSA-N
XLogP1.78
TPSA86.19 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.76
LogP ≤ 51.78
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

3-[1-amino-2-(oxan-2-yl)ethyl]-5-chloropyridin-2-amine
CID 113391501
[1-(5-chloro-2-methoxyphenyl)-2-(oxan-2-yl)ethyl]hydrazine
CID 105267580
3-[1-hydrazinyl-2-(oxan-2-yl)ethyl]pyridin-4-amine
CID 105267384
[1-(2-methylphenyl)-2-(oxan-2-yl)ethyl]hydrazine
CID 105267276
[1-(4-bromo-3-chloro-2-fluorophenyl)-2-(oxan-2-yl)ethyl]hydrazine
CID 106765387
[1-(4-methoxy-2,5-dimethylphenyl)-2-(oxan-2-yl)ethyl]hydrazine
CID 105267567
[1-(2-methoxyphenyl)-2-(oxan-2-yl)ethyl]hydrazine
CID 105267281
[2-(oxan-2-yl)-1-(5-propoxy-3-pyridinyl)ethyl]hydrazine
CID 105267561
[1-(2,4-dimethoxyphenyl)-2-(oxan-2-yl)ethyl]hydrazine
CID 105267581
5-chloro-3-(1-hydrazinyl-3-methoxypropyl)pyridin-2-amine
CID 105206436
1-(2,5-dichlorophenyl)-2-(oxan-2-yl)ethanol
CID 113391319
[1-(4-chloro-1-ethylpyrazol-5-yl)-2-(oxolan-2-yl)ethyl]hydrazine
CID 105198590

Frequently Asked Questions

What is the IUPAC name of 5-chloro-3-[1-hydrazinyl-2-(oxan-2-yl)ethyl]pyridin-2-amine?
The IUPAC name of 5-chloro-3-[1-hydrazinyl-2-(oxan-2-yl)ethyl]pyridin-2-amine (CID 105267477) is 5-chloro-3-[1-hydrazinyl-2-(oxan-2-yl)ethyl]pyridin-2-amine.
What is the SMILES notation for 5-chloro-3-[1-hydrazinyl-2-(oxan-2-yl)ethyl]pyridin-2-amine?
The canonical SMILES for 5-chloro-3-[1-hydrazinyl-2-(oxan-2-yl)ethyl]pyridin-2-amine is NNC(CC1CCCCO1)c1cc(Cl)cnc1N.
What is the InChIKey of 5-chloro-3-[1-hydrazinyl-2-(oxan-2-yl)ethyl]pyridin-2-amine?
The InChIKey is UIDJAOOPBVBIGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19ClN4O/c13-8-5-10(12(14)16-7-8)11(17-15)6-9-3-1-2-4-18-9/h5,7,9,11,17H,1-4,6,15H2,(H2,14,16).
What are the key properties of 5-chloro-3-[1-hydrazinyl-2-(oxan-2-yl)ethyl]pyridin-2-amine?
5-chloro-3-[1-hydrazinyl-2-(oxan-2-yl)ethyl]pyridin-2-amine has a molecular weight of 270.76 g/mol, XLogP of 1.78, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-3-[1-hydrazinyl-2-(oxan-2-yl)ethyl]pyridin-2-amine is sourced from PubChem (CID 105267477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).