1-(1-hydrazinyl-4-methoxy-4-methylpentyl)-N,N,3-trimethylcyclohexan-1-amine

C16H35N3O — CID 103026906

IUPAC1-(1-hydrazinyl-4-methoxy-4-methylpentyl)-N,N,3-trimethylcyclohexan-1-amine
SMILESCOC(C)(C)CCC(NN)C1(N(C)C)CCCC(C)C1
InChIInChI=1S/C16H35N3O/c1-13-8-7-10-16(12-13,19(4)5)14(18-17)9-11-15(2,3)20-6/h13-14,18H,7-12,17H2,1-6H3
InChIKeyRBDVFHVTENTJTG-UHFFFAOYSA-N
MW285.48 g/mol
LogP2.53
Rot. Bonds7

About 1-(1-hydrazinyl-4-methoxy-4-methylpentyl)-N,N,3-trimethylcyclohexan-1-amine

1-(1-hydrazinyl-4-methoxy-4-methylpentyl)-N,N,3-trimethylcyclohexan-1-amine (PubChem CID 103026906) has the molecular formula C16H35N3O and a molecular weight of 285.48 g/mol. Its IUPAC name is 1-(1-hydrazinyl-4-methoxy-4-methylpentyl)-N,N,3-trimethylcyclohexan-1-amine.

Molecular Properties

Compound Name1-(1-hydrazinyl-4-methoxy-4-methylpentyl)-N,N,3-trimethylcyclohexan-1-amine
PubChem CID103026906
Molecular FormulaC16H35N3O
Molecular Weight285.48 g/mol
Exact Mass285.28
IUPAC Name1-(1-hydrazinyl-4-methoxy-4-methylpentyl)-N,N,3-trimethylcyclohexan-1-amine
SMILESCOC(C)(C)CCC(NN)C1(N(C)C)CCCC(C)C1
InChIInChI=1S/C16H35N3O/c1-13-8-7-10-16(12-13,19(4)5)14(18-17)9-11-15(2,3)20-6/h13-14,18H,7-12,17H2,1-6H3
InChIKeyRBDVFHVTENTJTG-UHFFFAOYSA-N
XLogP2.53
TPSA50.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.48
LogP ≤ 52.53
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-[4-methoxy-4-methyl-1-(methylamino)pentyl]-N,N-dimethylcycloheptan-1-amine
CID 103035876
1-(1-hydrazinyloct-7-enyl)-N,N,3-trimethylcyclohexan-1-amine
CID 107012549
1-(1-hydrazinyl-3-methylpentyl)-N,N,3-trimethylcyclohexan-1-amine
CID 105243702
[4-methoxy-4-methyl-1-(1-methylcyclopentyl)pentyl]hydrazine
CID 103026538
[4-methoxy-4-methyl-1-(1-methylcyclopropyl)pentyl]hydrazine
CID 103026963
1-[2-(3-bromophenyl)-1-hydrazinylethyl]-N,N,3-trimethylcyclohexan-1-amine
CID 105243659
1-(3-cyclopropyl-1-hydrazinylpropyl)-N,N-dimethylcyclopentan-1-amine
CID 105242456
1-[4-methoxy-4-methyl-1-(propylamino)pentyl]-N,N-dimethylcyclohexan-1-amine
CID 103035868
1-[2-(2-fluorophenyl)-1-hydrazinylethyl]-N,N,3-trimethylcyclohexan-1-amine
CID 105243637
1-[2-(2-bromophenyl)-1-hydrazinylethyl]-N,N,3-trimethylcyclohexan-1-amine
CID 105243735
1-[2-methoxy-1-(propylamino)ethyl]-N,N,3-trimethylcyclohexan-1-amine
CID 79570649
1-[2-(3-bromothiophen-2-yl)-1-hydrazinylethyl]-N,N,3-trimethylcyclohexan-1-amine
CID 105243706

Frequently Asked Questions

What is the IUPAC name of 1-(1-hydrazinyl-4-methoxy-4-methylpentyl)-N,N,3-trimethylcyclohexan-1-amine?
The IUPAC name of 1-(1-hydrazinyl-4-methoxy-4-methylpentyl)-N,N,3-trimethylcyclohexan-1-amine (CID 103026906) is 1-(1-hydrazinyl-4-methoxy-4-methylpentyl)-N,N,3-trimethylcyclohexan-1-amine.
What is the SMILES notation for 1-(1-hydrazinyl-4-methoxy-4-methylpentyl)-N,N,3-trimethylcyclohexan-1-amine?
The canonical SMILES for 1-(1-hydrazinyl-4-methoxy-4-methylpentyl)-N,N,3-trimethylcyclohexan-1-amine is COC(C)(C)CCC(NN)C1(N(C)C)CCCC(C)C1.
What is the InChIKey of 1-(1-hydrazinyl-4-methoxy-4-methylpentyl)-N,N,3-trimethylcyclohexan-1-amine?
The InChIKey is RBDVFHVTENTJTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H35N3O/c1-13-8-7-10-16(12-13,19(4)5)14(18-17)9-11-15(2,3)20-6/h13-14,18H,7-12,17H2,1-6H3.
What are the key properties of 1-(1-hydrazinyl-4-methoxy-4-methylpentyl)-N,N,3-trimethylcyclohexan-1-amine?
1-(1-hydrazinyl-4-methoxy-4-methylpentyl)-N,N,3-trimethylcyclohexan-1-amine has a molecular weight of 285.48 g/mol, XLogP of 2.53, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-hydrazinyl-4-methoxy-4-methylpentyl)-N,N,3-trimethylcyclohexan-1-amine is sourced from PubChem (CID 103026906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).