(3-propylsulfanylphenyl)methylidenehydrazine

C10H14N2S — CID 168529321

IUPAC(3-propylsulfanylphenyl)methylidenehydrazine
SMILESCCCSc1cccc(C=NN)c1
InChIInChI=1S/C10H14N2S/c1-2-6-13-10-5-3-4-9(7-10)8-12-11/h3-5,7-8H,2,6,11H2,1H3
InChIKeyCEQWWBXHWMIDPU-UHFFFAOYSA-N
MW194.30 g/mol
LogP2.48
Rot. Bonds4

About (3-propylsulfanylphenyl)methylidenehydrazine

(3-propylsulfanylphenyl)methylidenehydrazine (PubChem CID 168529321) has the molecular formula C10H14N2S and a molecular weight of 194.30 g/mol. Its IUPAC name is (3-propylsulfanylphenyl)methylidenehydrazine.

Molecular Properties

Compound Name(3-propylsulfanylphenyl)methylidenehydrazine
PubChem CID168529321
Molecular FormulaC10H14N2S
Molecular Weight194.30 g/mol
Exact Mass194.09
IUPAC Name(3-propylsulfanylphenyl)methylidenehydrazine
SMILESCCCSc1cccc(C=NN)c1
InChIInChI=1S/C10H14N2S/c1-2-6-13-10-5-3-4-9(7-10)8-12-11/h3-5,7-8H,2,6,11H2,1H3
InChIKeyCEQWWBXHWMIDPU-UHFFFAOYSA-N
XLogP2.48
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.30
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[(3-propylsulfanylphenyl)methylideneamino]urea
CID 168532022
(3-propylsulfanylphenyl)methanamine
CID 66356001
1-[(3-butylsulfanylphenyl)methylideneamino]-4-methylimidazol-2-amine
CID 168628982
3-heptylsulfanylbenzaldehyde
CID 66355979
3-decylsulfanylbenzaldehyde
CID 66356420
ethane;[3-[(E)-hydrazinylidenemethyl]phenyl]mercury
CID 143139719
(1R)-1-(3-propylsulfanylphenyl)ethanol
CID 96718323
(3-methyl-4-propoxyphenyl)methylidenehydrazine
CID 168529274
1-(3-methanehydrazonoylphenyl)-N,N-dimethylmethanamine
CID 168530014
3-[2-(diethylamino)ethylsulfanyl]benzaldehyde
CID 66354510
4-propylsulfanylbenzene-1,2-diamine
CID 3017084
N-[(3-propylsulfanylphenyl)methyl]ethanamine
CID 66347645

Frequently Asked Questions

What is the IUPAC name of (3-propylsulfanylphenyl)methylidenehydrazine?
The IUPAC name of (3-propylsulfanylphenyl)methylidenehydrazine (CID 168529321) is (3-propylsulfanylphenyl)methylidenehydrazine.
What is the SMILES notation for (3-propylsulfanylphenyl)methylidenehydrazine?
The canonical SMILES for (3-propylsulfanylphenyl)methylidenehydrazine is CCCSc1cccc(C=NN)c1.
What is the InChIKey of (3-propylsulfanylphenyl)methylidenehydrazine?
The InChIKey is CEQWWBXHWMIDPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2S/c1-2-6-13-10-5-3-4-9(7-10)8-12-11/h3-5,7-8H,2,6,11H2,1H3.
What are the key properties of (3-propylsulfanylphenyl)methylidenehydrazine?
(3-propylsulfanylphenyl)methylidenehydrazine has a molecular weight of 194.30 g/mol, XLogP of 2.48, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-propylsulfanylphenyl)methylidenehydrazine is sourced from PubChem (CID 168529321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).