3-amino-N',N'-dimethyl-3-thiophen-2-ylpropanehydrazide

C9H15N3OS — CID 116849992

IUPAC3-amino-N',N'-dimethyl-3-thiophen-2-ylpropanehydrazide
SMILESCN(C)NC(=O)CC(N)c1cccs1
InChIInChI=1S/C9H15N3OS/c1-12(2)11-9(13)6-7(10)8-4-3-5-14-8/h3-5,7H,6,10H2,1-2H3,(H,11,13)
InChIKeyOIAPUAHFCCWJSF-UHFFFAOYSA-N
MW213.31 g/mol
LogP0.73
Rot. Bonds4

About 3-amino-N',N'-dimethyl-3-thiophen-2-ylpropanehydrazide

3-amino-N',N'-dimethyl-3-thiophen-2-ylpropanehydrazide (PubChem CID 116849992) has the molecular formula C9H15N3OS and a molecular weight of 213.31 g/mol. Its IUPAC name is 3-amino-N',N'-dimethyl-3-thiophen-2-ylpropanehydrazide.

Molecular Properties

Compound Name3-amino-N',N'-dimethyl-3-thiophen-2-ylpropanehydrazide
PubChem CID116849992
Molecular FormulaC9H15N3OS
Molecular Weight213.31 g/mol
Exact Mass213.09
IUPAC Name3-amino-N',N'-dimethyl-3-thiophen-2-ylpropanehydrazide
SMILESCN(C)NC(=O)CC(N)c1cccs1
InChIInChI=1S/C9H15N3OS/c1-12(2)11-9(13)6-7(10)8-4-3-5-14-8/h3-5,7H,6,10H2,1-2H3,(H,11,13)
InChIKeyOIAPUAHFCCWJSF-UHFFFAOYSA-N
XLogP0.73
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.31
LogP ≤ 50.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-amino-N',N'-dimethyl-3-pyridin-3-ylpropanehydrazide
CID 116850071
N'-methyl-1-thiophen-2-ylethane-1,2-diamine
CID 115287726
5-amino-5-thiophen-2-ylpentan-2-one
CID 116940647
(3R)-3-hydroxy-N,N-dimethyl-3-thiophen-2-ylpropanamide
CID 141411439
(3R)-3-amino-3-phenyl-N-[(1S)-1-thiophen-2-ylethyl]propanamide
CID 93104023
3-amino-3-phenyl-N-[(1S)-1-thiophen-2-ylethyl]propanamide
CID 81408213
5-amino-3-methyl-5-thiophen-2-ylpentanamide
CID 62933995
4-amino-4-thiophen-2-ylbutanamide
CID 60860619
(4R)-4-amino-4-thiophen-2-ylbutanoic acid
CID 28744265
N'-methyl-1-thiophen-2-ylpropane-1,3-diamine
CID 74600564
4-amino-4-thiophen-2-ylbutanoic acid
CID 21318673
(1S)-1-thiophen-2-ylpropane-1,3-diamine
CID 130817446

Frequently Asked Questions

What is the IUPAC name of 3-amino-N',N'-dimethyl-3-thiophen-2-ylpropanehydrazide?
The IUPAC name of 3-amino-N',N'-dimethyl-3-thiophen-2-ylpropanehydrazide (CID 116849992) is 3-amino-N',N'-dimethyl-3-thiophen-2-ylpropanehydrazide.
What is the SMILES notation for 3-amino-N',N'-dimethyl-3-thiophen-2-ylpropanehydrazide?
The canonical SMILES for 3-amino-N',N'-dimethyl-3-thiophen-2-ylpropanehydrazide is CN(C)NC(=O)CC(N)c1cccs1.
What is the InChIKey of 3-amino-N',N'-dimethyl-3-thiophen-2-ylpropanehydrazide?
The InChIKey is OIAPUAHFCCWJSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3OS/c1-12(2)11-9(13)6-7(10)8-4-3-5-14-8/h3-5,7H,6,10H2,1-2H3,(H,11,13).
What are the key properties of 3-amino-N',N'-dimethyl-3-thiophen-2-ylpropanehydrazide?
3-amino-N',N'-dimethyl-3-thiophen-2-ylpropanehydrazide has a molecular weight of 213.31 g/mol, XLogP of 0.73, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N',N'-dimethyl-3-thiophen-2-ylpropanehydrazide is sourced from PubChem (CID 116849992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).