1-[3,4-dihydro-2H-pyran-6-yl(hydrazinyl)methyl]-N,N-dimethylcyclopentan-1-amine

C13H25N3O — CID 102650051

IUPAC1-[3,4-dihydro-2H-pyran-6-yl(hydrazinyl)methyl]-N,N-dimethylcyclopentan-1-amine
SMILESCN(C)C1(C(NN)C2=CCCCO2)CCCC1
InChIInChI=1S/C13H25N3O/c1-16(2)13(8-4-5-9-13)12(15-14)11-7-3-6-10-17-11/h7,12,15H,3-6,8-10,14H2,1-2H3
InChIKeyGMZXCULWEZEUIU-UHFFFAOYSA-N
MW239.36 g/mol
LogP1.39
Rot. Bonds4

About 1-[3,4-dihydro-2H-pyran-6-yl(hydrazinyl)methyl]-N,N-dimethylcyclopentan-1-amine

1-[3,4-dihydro-2H-pyran-6-yl(hydrazinyl)methyl]-N,N-dimethylcyclopentan-1-amine (PubChem CID 102650051) has the molecular formula C13H25N3O and a molecular weight of 239.36 g/mol. Its IUPAC name is 1-[3,4-dihydro-2H-pyran-6-yl(hydrazinyl)methyl]-N,N-dimethylcyclopentan-1-amine.

Molecular Properties

Compound Name1-[3,4-dihydro-2H-pyran-6-yl(hydrazinyl)methyl]-N,N-dimethylcyclopentan-1-amine
PubChem CID102650051
Molecular FormulaC13H25N3O
Molecular Weight239.36 g/mol
Exact Mass239.20
IUPAC Name1-[3,4-dihydro-2H-pyran-6-yl(hydrazinyl)methyl]-N,N-dimethylcyclopentan-1-amine
SMILESCN(C)C1(C(NN)C2=CCCCO2)CCCC1
InChIInChI=1S/C13H25N3O/c1-16(2)13(8-4-5-9-13)12(15-14)11-7-3-6-10-17-11/h7,12,15H,3-6,8-10,14H2,1-2H3
InChIKeyGMZXCULWEZEUIU-UHFFFAOYSA-N
XLogP1.39
TPSA50.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 51.39
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-[3,4-dihydro-2H-pyran-6-yl(hydrazinyl)methyl]-N,N-dimethylcyclopentan-1-amine?
The IUPAC name of 1-[3,4-dihydro-2H-pyran-6-yl(hydrazinyl)methyl]-N,N-dimethylcyclopentan-1-amine (CID 102650051) is 1-[3,4-dihydro-2H-pyran-6-yl(hydrazinyl)methyl]-N,N-dimethylcyclopentan-1-amine.
What is the SMILES notation for 1-[3,4-dihydro-2H-pyran-6-yl(hydrazinyl)methyl]-N,N-dimethylcyclopentan-1-amine?
The canonical SMILES for 1-[3,4-dihydro-2H-pyran-6-yl(hydrazinyl)methyl]-N,N-dimethylcyclopentan-1-amine is CN(C)C1(C(NN)C2=CCCCO2)CCCC1.
What is the InChIKey of 1-[3,4-dihydro-2H-pyran-6-yl(hydrazinyl)methyl]-N,N-dimethylcyclopentan-1-amine?
The InChIKey is GMZXCULWEZEUIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O/c1-16(2)13(8-4-5-9-13)12(15-14)11-7-3-6-10-17-11/h7,12,15H,3-6,8-10,14H2,1-2H3.
What are the key properties of 1-[3,4-dihydro-2H-pyran-6-yl(hydrazinyl)methyl]-N,N-dimethylcyclopentan-1-amine?
1-[3,4-dihydro-2H-pyran-6-yl(hydrazinyl)methyl]-N,N-dimethylcyclopentan-1-amine has a molecular weight of 239.36 g/mol, XLogP of 1.39, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3,4-dihydro-2H-pyran-6-yl(hydrazinyl)methyl]-N,N-dimethylcyclopentan-1-amine is sourced from PubChem (CID 102650051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).