[1-(3-chloro-2-pyridinyl)-4-methoxy-4-methylpentyl]hydrazine

C12H20ClN3O — CID 103445658

IUPAC[1-(3-chloro-2-pyridinyl)-4-methoxy-4-methylpentyl]hydrazine
SMILESCOC(C)(C)CCC(NN)c1ncccc1Cl
InChIInChI=1S/C12H20ClN3O/c1-12(2,17-3)7-6-10(16-14)11-9(13)5-4-8-15-11/h4-5,8,10,16H,6-7,14H2,1-3H3
InChIKeyKUKDPEQONQTAFB-UHFFFAOYSA-N
MW257.76 g/mol
LogP2.44
Rot. Bonds6

About [1-(3-chloro-2-pyridinyl)-4-methoxy-4-methylpentyl]hydrazine

[1-(3-chloro-2-pyridinyl)-4-methoxy-4-methylpentyl]hydrazine (PubChem CID 103445658) has the molecular formula C12H20ClN3O and a molecular weight of 257.76 g/mol. Its IUPAC name is [1-(3-chloro-2-pyridinyl)-4-methoxy-4-methylpentyl]hydrazine.

Molecular Properties

Compound Name[1-(3-chloro-2-pyridinyl)-4-methoxy-4-methylpentyl]hydrazine
PubChem CID103445658
Molecular FormulaC12H20ClN3O
Molecular Weight257.76 g/mol
Exact Mass257.13
IUPAC Name[1-(3-chloro-2-pyridinyl)-4-methoxy-4-methylpentyl]hydrazine
SMILESCOC(C)(C)CCC(NN)c1ncccc1Cl
InChIInChI=1S/C12H20ClN3O/c1-12(2,17-3)7-6-10(16-14)11-9(13)5-4-8-15-11/h4-5,8,10,16H,6-7,14H2,1-3H3
InChIKeyKUKDPEQONQTAFB-UHFFFAOYSA-N
XLogP2.44
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.76
LogP ≤ 52.44
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

1-(3-chloro-2-pyridinyl)butylhydrazine
CID 103445669
[1-(3,4-dichlorophenyl)-4-methoxy-4-methylpentyl]hydrazine
CID 103026283
[2-(4-tert-butylphenyl)-1-(3-chloro-2-pyridinyl)ethyl]hydrazine
CID 103445951
1-(3-ethyl-2-pyridinyl)-4-methoxy-N,4-dimethylpentan-1-amine
CID 103036007
(4-methoxy-4-methyl-1-quinoxalin-6-ylpentyl)hydrazine
CID 103026296
[4-methoxy-4-methyl-1-(2-methylpyrazol-3-yl)pentyl]hydrazine
CID 103026636
3-[2-(3-chloro-2-pyridinyl)-2-hydrazinylethyl]pyridin-2-amine
CID 103445799
[4-methoxy-1-(6-methoxypyrimidin-4-yl)-4-methylpentyl]hydrazine
CID 103027166
[1-(2-chlorophenyl)sulfanyl-5-methoxy-5-methylhexan-2-yl]hydrazine
CID 103026842
(3-methoxy-3-methyl-1-quinolin-5-ylbutyl)hydrazine
CID 103025431
1-(3-chloro-2-pyridinyl)-2,2-dimethylpropan-1-amine
CID 103852479
[1-(2,6-dimethyl-4-pyridinyl)-4-methoxy-4-methylpentyl]hydrazine
CID 107504862

Frequently Asked Questions

What is the IUPAC name of [1-(3-chloro-2-pyridinyl)-4-methoxy-4-methylpentyl]hydrazine?
The IUPAC name of [1-(3-chloro-2-pyridinyl)-4-methoxy-4-methylpentyl]hydrazine (CID 103445658) is [1-(3-chloro-2-pyridinyl)-4-methoxy-4-methylpentyl]hydrazine.
What is the SMILES notation for [1-(3-chloro-2-pyridinyl)-4-methoxy-4-methylpentyl]hydrazine?
The canonical SMILES for [1-(3-chloro-2-pyridinyl)-4-methoxy-4-methylpentyl]hydrazine is COC(C)(C)CCC(NN)c1ncccc1Cl.
What is the InChIKey of [1-(3-chloro-2-pyridinyl)-4-methoxy-4-methylpentyl]hydrazine?
The InChIKey is KUKDPEQONQTAFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20ClN3O/c1-12(2,17-3)7-6-10(16-14)11-9(13)5-4-8-15-11/h4-5,8,10,16H,6-7,14H2,1-3H3.
What are the key properties of [1-(3-chloro-2-pyridinyl)-4-methoxy-4-methylpentyl]hydrazine?
[1-(3-chloro-2-pyridinyl)-4-methoxy-4-methylpentyl]hydrazine has a molecular weight of 257.76 g/mol, XLogP of 2.44, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-chloro-2-pyridinyl)-4-methoxy-4-methylpentyl]hydrazine is sourced from PubChem (CID 103445658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).