1-hydrazinyl-N,N,2-trimethyl-1-(5-oxaspiro[3.5]nonan-8-yl)propan-2-amine

C14H29N3O — CID 105239137

IUPAC1-hydrazinyl-N,N,2-trimethyl-1-(5-oxaspiro[3.5]nonan-8-yl)propan-2-amine
SMILESCN(C)C(C)(C)C(NN)C1CCOC2(CCC2)C1
InChIInChI=1S/C14H29N3O/c1-13(2,17(3)4)12(16-15)11-6-9-18-14(10-11)7-5-8-14/h11-12,16H,5-10,15H2,1-4H3
InChIKeyQWVRGLUAMVLOLA-UHFFFAOYSA-N
MW255.41 g/mol
LogP1.51
Rot. Bonds4

About 1-hydrazinyl-N,N,2-trimethyl-1-(5-oxaspiro[3.5]nonan-8-yl)propan-2-amine

1-hydrazinyl-N,N,2-trimethyl-1-(5-oxaspiro[3.5]nonan-8-yl)propan-2-amine (PubChem CID 105239137) has the molecular formula C14H29N3O and a molecular weight of 255.41 g/mol. Its IUPAC name is 1-hydrazinyl-N,N,2-trimethyl-1-(5-oxaspiro[3.5]nonan-8-yl)propan-2-amine.

Molecular Properties

Compound Name1-hydrazinyl-N,N,2-trimethyl-1-(5-oxaspiro[3.5]nonan-8-yl)propan-2-amine
PubChem CID105239137
Molecular FormulaC14H29N3O
Molecular Weight255.41 g/mol
Exact Mass255.23
IUPAC Name1-hydrazinyl-N,N,2-trimethyl-1-(5-oxaspiro[3.5]nonan-8-yl)propan-2-amine
SMILESCN(C)C(C)(C)C(NN)C1CCOC2(CCC2)C1
InChIInChI=1S/C14H29N3O/c1-13(2,17(3)4)12(16-15)11-6-9-18-14(10-11)7-5-8-14/h11-12,16H,5-10,15H2,1-4H3
InChIKeyQWVRGLUAMVLOLA-UHFFFAOYSA-N
XLogP1.51
TPSA50.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.41
LogP ≤ 51.51
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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Frequently Asked Questions

What is the IUPAC name of 1-hydrazinyl-N,N,2-trimethyl-1-(5-oxaspiro[3.5]nonan-8-yl)propan-2-amine?
The IUPAC name of 1-hydrazinyl-N,N,2-trimethyl-1-(5-oxaspiro[3.5]nonan-8-yl)propan-2-amine (CID 105239137) is 1-hydrazinyl-N,N,2-trimethyl-1-(5-oxaspiro[3.5]nonan-8-yl)propan-2-amine.
What is the SMILES notation for 1-hydrazinyl-N,N,2-trimethyl-1-(5-oxaspiro[3.5]nonan-8-yl)propan-2-amine?
The canonical SMILES for 1-hydrazinyl-N,N,2-trimethyl-1-(5-oxaspiro[3.5]nonan-8-yl)propan-2-amine is CN(C)C(C)(C)C(NN)C1CCOC2(CCC2)C1.
What is the InChIKey of 1-hydrazinyl-N,N,2-trimethyl-1-(5-oxaspiro[3.5]nonan-8-yl)propan-2-amine?
The InChIKey is QWVRGLUAMVLOLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O/c1-13(2,17(3)4)12(16-15)11-6-9-18-14(10-11)7-5-8-14/h11-12,16H,5-10,15H2,1-4H3.
What are the key properties of 1-hydrazinyl-N,N,2-trimethyl-1-(5-oxaspiro[3.5]nonan-8-yl)propan-2-amine?
1-hydrazinyl-N,N,2-trimethyl-1-(5-oxaspiro[3.5]nonan-8-yl)propan-2-amine has a molecular weight of 255.41 g/mol, XLogP of 1.51, 4 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-(5-oxaspiro[3.5]nonan-8-yl)propan-2-amine is sourced from PubChem (CID 105239137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).