1-[hydrazinyl(oxolan-3-yl)methyl]-N,N,4-trimethylcyclohexan-1-amine

C14H29N3O — CID 105243421

IUPAC1-[hydrazinyl(oxolan-3-yl)methyl]-N,N,4-trimethylcyclohexan-1-amine
SMILESCC1CCC(C(NN)C2CCOC2)(N(C)C)CC1
InChIInChI=1S/C14H29N3O/c1-11-4-7-14(8-5-11,17(2)3)13(16-15)12-6-9-18-10-12/h11-13,16H,4-10,15H2,1-3H3
InChIKeyVCVQOUHJLPGFKC-UHFFFAOYSA-N
MW255.41 g/mol
LogP1.37
Rot. Bonds4

About 1-[hydrazinyl(oxolan-3-yl)methyl]-N,N,4-trimethylcyclohexan-1-amine

1-[hydrazinyl(oxolan-3-yl)methyl]-N,N,4-trimethylcyclohexan-1-amine (PubChem CID 105243421) has the molecular formula C14H29N3O and a molecular weight of 255.41 g/mol. Its IUPAC name is 1-[hydrazinyl(oxolan-3-yl)methyl]-N,N,4-trimethylcyclohexan-1-amine.

Molecular Properties

Compound Name1-[hydrazinyl(oxolan-3-yl)methyl]-N,N,4-trimethylcyclohexan-1-amine
PubChem CID105243421
Molecular FormulaC14H29N3O
Molecular Weight255.41 g/mol
Exact Mass255.23
IUPAC Name1-[hydrazinyl(oxolan-3-yl)methyl]-N,N,4-trimethylcyclohexan-1-amine
SMILESCC1CCC(C(NN)C2CCOC2)(N(C)C)CC1
InChIInChI=1S/C14H29N3O/c1-11-4-7-14(8-5-11,17(2)3)13(16-15)12-6-9-18-10-12/h11-13,16H,4-10,15H2,1-3H3
InChIKeyVCVQOUHJLPGFKC-UHFFFAOYSA-N
XLogP1.37
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 ≤ 51.37
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-[amino(oxolan-3-yl)methyl]-N,N,4-trimethylcyclohexan-1-amine
CID 79074502
1-[cycloheptyl(hydrazinyl)methyl]-N,N,4-trimethylcyclohexan-1-amine
CID 105243452
N,N-dimethyl-1-[methylamino(oxolan-3-yl)methyl]cyclopentan-1-amine
CID 79069983
N,N-diethyl-1-[hydrazinyl(oxolan-3-yl)methyl]cyclopentan-1-amine
CID 105242602
N,N-diethyl-1-[hydrazinyl(oxan-3-yl)methyl]cyclopentan-1-amine
CID 107139613
1-(2-cyclopentyl-1-hydrazinylethyl)-N,N,4-trimethylcyclohexan-1-amine
CID 105243419
[oxolan-3-yl-(1-phenylcyclopentyl)methyl]hydrazine
CID 105217442
1-(1-hydrazinyl-2-methylprop-2-enyl)-N,N,4-trimethylcyclohexan-1-amine
CID 105243542
1-[3,4-dihydro-2H-pyran-5-yl(hydrazinyl)methyl]-N,N,4-trimethylcyclohexan-1-amine
CID 105243404
1-[1-(dimethylamino)-4-methylcyclohexyl]-2-(oxan-4-yl)ethanol
CID 79081968
[(3-methylcyclopentyl)-(oxolan-3-yl)methyl]hydrazine
CID 105233097
1-(1-hydrazinylhexyl)-N,N,4-trimethylcyclohexan-1-amine
CID 105243536

Frequently Asked Questions

What is the IUPAC name of 1-[hydrazinyl(oxolan-3-yl)methyl]-N,N,4-trimethylcyclohexan-1-amine?
The IUPAC name of 1-[hydrazinyl(oxolan-3-yl)methyl]-N,N,4-trimethylcyclohexan-1-amine (CID 105243421) is 1-[hydrazinyl(oxolan-3-yl)methyl]-N,N,4-trimethylcyclohexan-1-amine.
What is the SMILES notation for 1-[hydrazinyl(oxolan-3-yl)methyl]-N,N,4-trimethylcyclohexan-1-amine?
The canonical SMILES for 1-[hydrazinyl(oxolan-3-yl)methyl]-N,N,4-trimethylcyclohexan-1-amine is CC1CCC(C(NN)C2CCOC2)(N(C)C)CC1.
What is the InChIKey of 1-[hydrazinyl(oxolan-3-yl)methyl]-N,N,4-trimethylcyclohexan-1-amine?
The InChIKey is VCVQOUHJLPGFKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O/c1-11-4-7-14(8-5-11,17(2)3)13(16-15)12-6-9-18-10-12/h11-13,16H,4-10,15H2,1-3H3.
What are the key properties of 1-[hydrazinyl(oxolan-3-yl)methyl]-N,N,4-trimethylcyclohexan-1-amine?
1-[hydrazinyl(oxolan-3-yl)methyl]-N,N,4-trimethylcyclohexan-1-amine has a molecular weight of 255.41 g/mol, XLogP of 1.37, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[hydrazinyl(oxolan-3-yl)methyl]-N,N,4-trimethylcyclohexan-1-amine is sourced from PubChem (CID 105243421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).