1,1-dimethyl-2-[(5-naphthalen-1-yl-1,3-thiazol-2-yl)methyl]hydrazine

C16H17N3S — CID 53272757

IUPAC1,1-dimethyl-2-[(5-naphthalen-1-yl-1,3-thiazol-2-yl)methyl]hydrazine
SMILESCN(C)NCc1ncc(-c2cccc3ccccc23)s1
InChIInChI=1S/C16H17N3S/c1-19(2)18-11-16-17-10-15(20-16)14-9-5-7-12-6-3-4-8-13(12)14/h3-10,18H,11H2,1-2H3
InChIKeyMLLAMKAPKOOAGQ-UHFFFAOYSA-N
MW283.40 g/mol
LogP3.53
Rot. Bonds4

About 1,1-dimethyl-2-[(5-naphthalen-1-yl-1,3-thiazol-2-yl)methyl]hydrazine

1,1-dimethyl-2-[(5-naphthalen-1-yl-1,3-thiazol-2-yl)methyl]hydrazine (PubChem CID 53272757) has the molecular formula C16H17N3S and a molecular weight of 283.40 g/mol. Its IUPAC name is 1,1-dimethyl-2-[(5-naphthalen-1-yl-1,3-thiazol-2-yl)methyl]hydrazine.

Molecular Properties

Compound Name1,1-dimethyl-2-[(5-naphthalen-1-yl-1,3-thiazol-2-yl)methyl]hydrazine
PubChem CID53272757
Molecular FormulaC16H17N3S
Molecular Weight283.40 g/mol
Exact Mass283.11
IUPAC Name1,1-dimethyl-2-[(5-naphthalen-1-yl-1,3-thiazol-2-yl)methyl]hydrazine
SMILESCN(C)NCc1ncc(-c2cccc3ccccc23)s1
InChIInChI=1S/C16H17N3S/c1-19(2)18-11-16-17-10-15(20-16)14-9-5-7-12-6-3-4-8-13(12)14/h3-10,18H,11H2,1-2H3
InChIKeyMLLAMKAPKOOAGQ-UHFFFAOYSA-N
XLogP3.53
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.40
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1,1-dimethyl-2-[(5-naphthalen-1-yl-1,3-thiazol-2-yl)methyl]hydrazine?
The IUPAC name of 1,1-dimethyl-2-[(5-naphthalen-1-yl-1,3-thiazol-2-yl)methyl]hydrazine (CID 53272757) is 1,1-dimethyl-2-[(5-naphthalen-1-yl-1,3-thiazol-2-yl)methyl]hydrazine.
What is the SMILES notation for 1,1-dimethyl-2-[(5-naphthalen-1-yl-1,3-thiazol-2-yl)methyl]hydrazine?
The canonical SMILES for 1,1-dimethyl-2-[(5-naphthalen-1-yl-1,3-thiazol-2-yl)methyl]hydrazine is CN(C)NCc1ncc(-c2cccc3ccccc23)s1.
What is the InChIKey of 1,1-dimethyl-2-[(5-naphthalen-1-yl-1,3-thiazol-2-yl)methyl]hydrazine?
The InChIKey is MLLAMKAPKOOAGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3S/c1-19(2)18-11-16-17-10-15(20-16)14-9-5-7-12-6-3-4-8-13(12)14/h3-10,18H,11H2,1-2H3.
What are the key properties of 1,1-dimethyl-2-[(5-naphthalen-1-yl-1,3-thiazol-2-yl)methyl]hydrazine?
1,1-dimethyl-2-[(5-naphthalen-1-yl-1,3-thiazol-2-yl)methyl]hydrazine has a molecular weight of 283.40 g/mol, XLogP of 3.53, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-dimethyl-2-[(5-naphthalen-1-yl-1,3-thiazol-2-yl)methyl]hydrazine is sourced from PubChem (CID 53272757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).