1-hydrazinyl-N,N,2-trimethyl-1-thiophen-3-ylbutan-2-amine

C11H21N3S — CID 105240466

IUPAC1-hydrazinyl-N,N,2-trimethyl-1-thiophen-3-ylbutan-2-amine
SMILESCCC(C)(C(NN)c1ccsc1)N(C)C
InChIInChI=1S/C11H21N3S/c1-5-11(2,14(3)4)10(13-12)9-6-7-15-8-9/h6-8,10,13H,5,12H2,1-4H3
InChIKeyHGXIVSXGZRMSLQ-UHFFFAOYSA-N
MW227.38 g/mol
LogP1.98
Rot. Bonds5

About 1-hydrazinyl-N,N,2-trimethyl-1-thiophen-3-ylbutan-2-amine

1-hydrazinyl-N,N,2-trimethyl-1-thiophen-3-ylbutan-2-amine (PubChem CID 105240466) has the molecular formula C11H21N3S and a molecular weight of 227.38 g/mol. Its IUPAC name is 1-hydrazinyl-N,N,2-trimethyl-1-thiophen-3-ylbutan-2-amine.

Molecular Properties

Compound Name1-hydrazinyl-N,N,2-trimethyl-1-thiophen-3-ylbutan-2-amine
PubChem CID105240466
Molecular FormulaC11H21N3S
Molecular Weight227.38 g/mol
Exact Mass227.15
IUPAC Name1-hydrazinyl-N,N,2-trimethyl-1-thiophen-3-ylbutan-2-amine
SMILESCCC(C)(C(NN)c1ccsc1)N(C)C
InChIInChI=1S/C11H21N3S/c1-5-11(2,14(3)4)10(13-12)9-6-7-15-8-9/h6-8,10,13H,5,12H2,1-4H3
InChIKeyHGXIVSXGZRMSLQ-UHFFFAOYSA-N
XLogP1.98
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.38
LogP ≤ 51.98
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-(3,4-dimethoxyphenyl)-1-hydrazinyl-N,N,2-trimethylbutan-2-amine
CID 105240484
(2-methyl-2-methylsulfonyl-1-thiophen-3-ylpropyl)hydrazine
CID 105312096
(2-methyl-2-piperidin-1-yl-1-thiophen-3-ylpropyl)hydrazine
CID 105239795
N,2,2-trimethyl-1-thiophen-3-ylpropan-1-amine
CID 62395733
1-N-methyl-1-N-(2-methylbutan-2-yl)-1-thiophen-3-ylpropane-1,2-diamine
CID 63983723
1-hydrazinyl-N,N,2-trimethyl-1-(5-propan-2-yloxy-3-pyridinyl)butan-2-amine
CID 105240684
3-(3-ethyl-3-methylpentan-2-yl)thiophene
CID 139314791
3-methyl-N-(1-thiophen-3-ylethyl)pentan-3-amine
CID 115920356
[2-[(2-methylpropan-2-yl)oxy]-1-thiophen-3-ylethyl]hydrazine
CID 105312095
1-(2-cyclobutylphenyl)-1-hydrazinyl-N,N,2-trimethylbutan-2-amine
CID 105240511
(1R)-1-thiophen-3-ylpropan-1-amine;hydrochloride
CID 171210593
1-hydrazinyl-N,N,2-trimethyl-1-(1-methylimidazol-2-yl)butan-2-amine
CID 105240575

Frequently Asked Questions

What is the IUPAC name of 1-hydrazinyl-N,N,2-trimethyl-1-thiophen-3-ylbutan-2-amine?
The IUPAC name of 1-hydrazinyl-N,N,2-trimethyl-1-thiophen-3-ylbutan-2-amine (CID 105240466) is 1-hydrazinyl-N,N,2-trimethyl-1-thiophen-3-ylbutan-2-amine.
What is the SMILES notation for 1-hydrazinyl-N,N,2-trimethyl-1-thiophen-3-ylbutan-2-amine?
The canonical SMILES for 1-hydrazinyl-N,N,2-trimethyl-1-thiophen-3-ylbutan-2-amine is CCC(C)(C(NN)c1ccsc1)N(C)C.
What is the InChIKey of 1-hydrazinyl-N,N,2-trimethyl-1-thiophen-3-ylbutan-2-amine?
The InChIKey is HGXIVSXGZRMSLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3S/c1-5-11(2,14(3)4)10(13-12)9-6-7-15-8-9/h6-8,10,13H,5,12H2,1-4H3.
What are the key properties of 1-hydrazinyl-N,N,2-trimethyl-1-thiophen-3-ylbutan-2-amine?
1-hydrazinyl-N,N,2-trimethyl-1-thiophen-3-ylbutan-2-amine has a molecular weight of 227.38 g/mol, XLogP of 1.98, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydrazinyl-N,N,2-trimethyl-1-thiophen-3-ylbutan-2-amine is sourced from PubChem (CID 105240466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).