N-[(2-hydrazinyl-1,3-thiazol-5-yl)methyl]-N,2-dimethylbutan-1-amine

C10H20N4S — CID 79763890

IUPACN-[(2-hydrazinyl-1,3-thiazol-5-yl)methyl]-N,2-dimethylbutan-1-amine
SMILESCCC(C)CN(C)Cc1cnc(NN)s1
InChIInChI=1S/C10H20N4S/c1-4-8(2)6-14(3)7-9-5-12-10(13-11)15-9/h5,8H,4,6-7,11H2,1-3H3,(H,12,13)
InChIKeyGGIPEOPIVWSWGJ-UHFFFAOYSA-N
MW228.36 g/mol
LogP1.91
Rot. Bonds6

About N-[(2-hydrazinyl-1,3-thiazol-5-yl)methyl]-N,2-dimethylbutan-1-amine

N-[(2-hydrazinyl-1,3-thiazol-5-yl)methyl]-N,2-dimethylbutan-1-amine (PubChem CID 79763890) has the molecular formula C10H20N4S and a molecular weight of 228.36 g/mol. Its IUPAC name is N-[(2-hydrazinyl-1,3-thiazol-5-yl)methyl]-N,2-dimethylbutan-1-amine.

Molecular Properties

Compound NameN-[(2-hydrazinyl-1,3-thiazol-5-yl)methyl]-N,2-dimethylbutan-1-amine
PubChem CID79763890
Molecular FormulaC10H20N4S
Molecular Weight228.36 g/mol
Exact Mass228.14
IUPAC NameN-[(2-hydrazinyl-1,3-thiazol-5-yl)methyl]-N,2-dimethylbutan-1-amine
SMILESCCC(C)CN(C)Cc1cnc(NN)s1
InChIInChI=1S/C10H20N4S/c1-4-8(2)6-14(3)7-9-5-12-10(13-11)15-9/h5,8H,4,6-7,11H2,1-3H3,(H,12,13)
InChIKeyGGIPEOPIVWSWGJ-UHFFFAOYSA-N
XLogP1.91
TPSA54.18 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.36
LogP ≤ 51.91
H-Bond Donors ≤ 52
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

2-Hydrazinyl-5-methylthiazole
CID 45076310
5-[[cyclobutylmethyl(methyl)amino]methyl]-N,N-dimethyl-1,3-thiazol-2-amine
CID 71912730
N-[(2-hydrazinyl-1,3-thiazol-5-yl)methyl]-N-(2,2,2-trifluoroethyl)propan-2-amine
CID 79764246
N-ethyl-2,2,2-trifluoro-N-[(2-hydrazinyl-1,3-thiazol-5-yl)methyl]ethanamine
CID 79764247
N-[(2-hydrazinyl-1,3-thiazol-5-yl)methyl]-N-(2,2,2-trifluoroethyl)cyclopropanamine
CID 79764380
N-[(2-hydrazinyl-1,3-thiazol-5-yl)methyl]-N-(2,2,2-trifluoroethyl)propan-1-amine
CID 79764512
3,3,3-trifluoro-N-[(2-hydrazinyl-1,3-thiazol-5-yl)methyl]-N-methylpropan-1-amine
CID 79765284
[5-[[3-(Trifluoromethyl)piperidin-1-yl]methyl]-1,3-thiazol-2-yl]hydrazine
CID 79765285
[5-[[4-(2,2,2-Trifluoroethyl)piperazin-1-yl]methyl]-1,3-thiazol-2-yl]hydrazine
CID 79765409
[5-[[4-(Trifluoromethyl)piperidin-1-yl]methyl]-1,3-thiazol-2-yl]hydrazine
CID 79765412
2,2,2-trifluoro-N-[(2-hydrazinyl-1,3-thiazol-5-yl)methyl]-N-methylethanamine
CID 79775000
2,2-difluoro-N-[(2-hydrazinyl-1,3-thiazol-5-yl)methyl]-N-methylethanamine
CID 116317487

Frequently Asked Questions

What is the IUPAC name of N-[(2-hydrazinyl-1,3-thiazol-5-yl)methyl]-N,2-dimethylbutan-1-amine?
The IUPAC name of N-[(2-hydrazinyl-1,3-thiazol-5-yl)methyl]-N,2-dimethylbutan-1-amine (CID 79763890) is N-[(2-hydrazinyl-1,3-thiazol-5-yl)methyl]-N,2-dimethylbutan-1-amine.
What is the SMILES notation for N-[(2-hydrazinyl-1,3-thiazol-5-yl)methyl]-N,2-dimethylbutan-1-amine?
The canonical SMILES for N-[(2-hydrazinyl-1,3-thiazol-5-yl)methyl]-N,2-dimethylbutan-1-amine is CCC(C)CN(C)Cc1cnc(NN)s1.
What is the InChIKey of N-[(2-hydrazinyl-1,3-thiazol-5-yl)methyl]-N,2-dimethylbutan-1-amine?
The InChIKey is GGIPEOPIVWSWGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N4S/c1-4-8(2)6-14(3)7-9-5-12-10(13-11)15-9/h5,8H,4,6-7,11H2,1-3H3,(H,12,13).
What are the key properties of N-[(2-hydrazinyl-1,3-thiazol-5-yl)methyl]-N,2-dimethylbutan-1-amine?
N-[(2-hydrazinyl-1,3-thiazol-5-yl)methyl]-N,2-dimethylbutan-1-amine has a molecular weight of 228.36 g/mol, XLogP of 1.91, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-hydrazinyl-1,3-thiazol-5-yl)methyl]-N,2-dimethylbutan-1-amine is sourced from PubChem (CID 79763890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).