N,N-diethyl-1-[hydrazinyl(oxan-3-yl)methyl]cyclopentan-1-amine

C15H31N3O — CID 107139613

IUPACN,N-diethyl-1-[hydrazinyl(oxan-3-yl)methyl]cyclopentan-1-amine
SMILESCCN(CC)C1(C(NN)C2CCCOC2)CCCC1
InChIInChI=1S/C15H31N3O/c1-3-18(4-2)15(9-5-6-10-15)14(17-16)13-8-7-11-19-12-13/h13-14,17H,3-12,16H2,1-2H3
InChIKeyXWUADIFGGOSKFI-UHFFFAOYSA-N
MW269.43 g/mol
LogP1.90
Rot. Bonds6

About N,N-diethyl-1-[hydrazinyl(oxan-3-yl)methyl]cyclopentan-1-amine

N,N-diethyl-1-[hydrazinyl(oxan-3-yl)methyl]cyclopentan-1-amine (PubChem CID 107139613) has the molecular formula C15H31N3O and a molecular weight of 269.43 g/mol. Its IUPAC name is N,N-diethyl-1-[hydrazinyl(oxan-3-yl)methyl]cyclopentan-1-amine.

Molecular Properties

Compound NameN,N-diethyl-1-[hydrazinyl(oxan-3-yl)methyl]cyclopentan-1-amine
PubChem CID107139613
Molecular FormulaC15H31N3O
Molecular Weight269.43 g/mol
Exact Mass269.25
IUPAC NameN,N-diethyl-1-[hydrazinyl(oxan-3-yl)methyl]cyclopentan-1-amine
SMILESCCN(CC)C1(C(NN)C2CCCOC2)CCCC1
InChIInChI=1S/C15H31N3O/c1-3-18(4-2)15(9-5-6-10-15)14(17-16)13-8-7-11-19-12-13/h13-14,17H,3-12,16H2,1-2H3
InChIKeyXWUADIFGGOSKFI-UHFFFAOYSA-N
XLogP1.90
TPSA50.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.43
LogP ≤ 51.90
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

N,N-diethyl-1-[hydrazinyl(oxolan-3-yl)methyl]cyclopentan-1-amine
CID 105242602
N,N-diethyl-1-[oxan-3-yl(propylamino)methyl]cyclopentan-1-amine
CID 107136596
N,N-diethyl-1-[hydrazinyl-(4-methylcyclohexyl)methyl]cyclopentan-1-amine
CID 105242683
1-[hydrazinyl(oxolan-3-yl)methyl]-N,N,4-trimethylcyclohexan-1-amine
CID 105243421
[2,3-dimethyl-1-(oxan-3-yl)butyl]hydrazine
CID 107139917
[3-ethyl-1-(oxan-3-yl)pentyl]hydrazine
CID 105230093
N,N-dimethyl-1-[methylamino(oxolan-3-yl)methyl]cyclopentan-1-amine
CID 79069983
N-methyl-1-(2-methyloxan-2-yl)-1-(oxan-3-yl)methanamine
CID 107136743
[3-methyl-1-(oxan-3-yl)pentyl]hydrazine
CID 105230031
2-N,2-N,2-triethyl-1-(oxan-3-yl)butane-1,2-diamine
CID 107136583
(1R)-1-[(3S)-oxan-3-yl]propan-1-amine
CID 96636720
[2-ethyl-1-(oxan-3-yl)-2-pyrrolidin-1-ylbutyl]hydrazine
CID 107139611

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-1-[hydrazinyl(oxan-3-yl)methyl]cyclopentan-1-amine?
The IUPAC name of N,N-diethyl-1-[hydrazinyl(oxan-3-yl)methyl]cyclopentan-1-amine (CID 107139613) is N,N-diethyl-1-[hydrazinyl(oxan-3-yl)methyl]cyclopentan-1-amine.
What is the SMILES notation for N,N-diethyl-1-[hydrazinyl(oxan-3-yl)methyl]cyclopentan-1-amine?
The canonical SMILES for N,N-diethyl-1-[hydrazinyl(oxan-3-yl)methyl]cyclopentan-1-amine is CCN(CC)C1(C(NN)C2CCCOC2)CCCC1.
What is the InChIKey of N,N-diethyl-1-[hydrazinyl(oxan-3-yl)methyl]cyclopentan-1-amine?
The InChIKey is XWUADIFGGOSKFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3O/c1-3-18(4-2)15(9-5-6-10-15)14(17-16)13-8-7-11-19-12-13/h13-14,17H,3-12,16H2,1-2H3.
What are the key properties of N,N-diethyl-1-[hydrazinyl(oxan-3-yl)methyl]cyclopentan-1-amine?
N,N-diethyl-1-[hydrazinyl(oxan-3-yl)methyl]cyclopentan-1-amine has a molecular weight of 269.43 g/mol, XLogP of 1.90, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-1-[hydrazinyl(oxan-3-yl)methyl]cyclopentan-1-amine is sourced from PubChem (CID 107139613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).