1-propan-2-ylsulfanyltetradecan-2-ylhydrazine

C17H38N2S — CID 105226035

IUPAC1-propan-2-ylsulfanyltetradecan-2-ylhydrazine
SMILESCCCCCCCCCCCCC(CSC(C)C)NN
InChIInChI=1S/C17H38N2S/c1-4-5-6-7-8-9-10-11-12-13-14-17(19-18)15-20-16(2)3/h16-17,19H,4-15,18H2,1-3H3
InChIKeyKSOROZACJLPOHM-UHFFFAOYSA-N
MW302.57 g/mol
LogP5.27
Rot. Bonds15

About 1-propan-2-ylsulfanyltetradecan-2-ylhydrazine

1-propan-2-ylsulfanyltetradecan-2-ylhydrazine (PubChem CID 105226035) has the molecular formula C17H38N2S and a molecular weight of 302.57 g/mol. Its IUPAC name is 1-propan-2-ylsulfanyltetradecan-2-ylhydrazine.

Molecular Properties

Compound Name1-propan-2-ylsulfanyltetradecan-2-ylhydrazine
PubChem CID105226035
Molecular FormulaC17H38N2S
Molecular Weight302.57 g/mol
Exact Mass302.28
IUPAC Name1-propan-2-ylsulfanyltetradecan-2-ylhydrazine
SMILESCCCCCCCCCCCCC(CSC(C)C)NN
InChIInChI=1S/C17H38N2S/c1-4-5-6-7-8-9-10-11-12-13-14-17(19-18)15-20-16(2)3/h16-17,19H,4-15,18H2,1-3H3
InChIKeyKSOROZACJLPOHM-UHFFFAOYSA-N
XLogP5.27
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds15
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500302.57
LogP ≤ 55.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-propan-2-ylsulfanylnonan-2-ylhydrazine
CID 105226034
1-propan-2-ylsulfanylundecan-2-ylhydrazine
CID 105226075
1-ethylsulfanylnonan-2-ylhydrazine
CID 105225292
1-propylsulfanyldecan-2-ylhydrazine
CID 105225668
pentadecan-3-ylhydrazine
CID 105200968
tridecan-3-ylhydrazine
CID 105201157
1-tert-butylsulfanylheptan-2-ylhydrazine
CID 105226571
1-propan-2-ylsulfanyldodecan-2-amine
CID 65131587
4-methylpentadecan-6-ylhydrazine
CID 105298107
1-phenylsulfanylheptan-2-ylhydrazine
CID 105228217
1-propan-2-yloxydecan-2-ylhydrazine
CID 105294338
1-methoxytetradecan-2-ylhydrazine
CID 105207172

Frequently Asked Questions

What is the IUPAC name of 1-propan-2-ylsulfanyltetradecan-2-ylhydrazine?
The IUPAC name of 1-propan-2-ylsulfanyltetradecan-2-ylhydrazine (CID 105226035) is 1-propan-2-ylsulfanyltetradecan-2-ylhydrazine.
What is the SMILES notation for 1-propan-2-ylsulfanyltetradecan-2-ylhydrazine?
The canonical SMILES for 1-propan-2-ylsulfanyltetradecan-2-ylhydrazine is CCCCCCCCCCCCC(CSC(C)C)NN.
What is the InChIKey of 1-propan-2-ylsulfanyltetradecan-2-ylhydrazine?
The InChIKey is KSOROZACJLPOHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H38N2S/c1-4-5-6-7-8-9-10-11-12-13-14-17(19-18)15-20-16(2)3/h16-17,19H,4-15,18H2,1-3H3.
What are the key properties of 1-propan-2-ylsulfanyltetradecan-2-ylhydrazine?
1-propan-2-ylsulfanyltetradecan-2-ylhydrazine has a molecular weight of 302.57 g/mol, XLogP of 5.27, 15 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-propan-2-ylsulfanyltetradecan-2-ylhydrazine is sourced from PubChem (CID 105226035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).