1-(1-hydrazinyl-4-methylpent-4-enyl)-N,N,4-trimethylcyclohexan-1-amine

C15H31N3 — CID 105243454

IUPAC1-(1-hydrazinyl-4-methylpent-4-enyl)-N,N,4-trimethylcyclohexan-1-amine
SMILESC=C(C)CCC(NN)C1(N(C)C)CCC(C)CC1
InChIInChI=1S/C15H31N3/c1-12(2)6-7-14(17-16)15(18(4)5)10-8-13(3)9-11-15/h13-14,17H,1,6-11,16H2,2-5H3
InChIKeyQLCVMCIYVXUWBV-UHFFFAOYSA-N
MW253.43 g/mol
LogP2.69
Rot. Bonds6

About 1-(1-hydrazinyl-4-methylpent-4-enyl)-N,N,4-trimethylcyclohexan-1-amine

1-(1-hydrazinyl-4-methylpent-4-enyl)-N,N,4-trimethylcyclohexan-1-amine (PubChem CID 105243454) has the molecular formula C15H31N3 and a molecular weight of 253.43 g/mol. Its IUPAC name is 1-(1-hydrazinyl-4-methylpent-4-enyl)-N,N,4-trimethylcyclohexan-1-amine.

Molecular Properties

Compound Name1-(1-hydrazinyl-4-methylpent-4-enyl)-N,N,4-trimethylcyclohexan-1-amine
PubChem CID105243454
Molecular FormulaC15H31N3
Molecular Weight253.43 g/mol
Exact Mass253.25
IUPAC Name1-(1-hydrazinyl-4-methylpent-4-enyl)-N,N,4-trimethylcyclohexan-1-amine
SMILESC=C(C)CCC(NN)C1(N(C)C)CCC(C)CC1
InChIInChI=1S/C15H31N3/c1-12(2)6-7-14(17-16)15(18(4)5)10-8-13(3)9-11-15/h13-14,17H,1,6-11,16H2,2-5H3
InChIKeyQLCVMCIYVXUWBV-UHFFFAOYSA-N
XLogP2.69
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.43
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-[1-(dimethylamino)-4-methylcyclohexyl]-4-methylpent-4-en-1-ol
CID 114473947
1-(1-hydrazinylhexyl)-N,N,4-trimethylcyclohexan-1-amine
CID 105243536
1-(2-cyclopentyl-1-hydrazinylethyl)-N,N,4-trimethylcyclohexan-1-amine
CID 105243419
1-(1-hydrazinyl-2-methylprop-2-enyl)-N,N,4-trimethylcyclohexan-1-amine
CID 105243542
1-[1-hydrazinyl-3-(1-methylpyrazol-4-yl)propyl]-N,N,4-trimethylcyclohexan-1-amine
CID 103026902
N,N,4-trimethyl-1-[1-(methylamino)pent-4-enyl]cyclohexan-1-amine
CID 79074440
1-[2-(2-bromophenyl)-1-hydrazinylethyl]-N,N,4-trimethylcyclohexan-1-amine
CID 105243555
1-(1-amino-4-methylpent-4-enyl)-N,N,3-trimethylcyclohexan-1-amine
CID 114475288
1-(2-cyclohexyl-1-hydrazinylethyl)-N,N-dimethylcycloheptan-1-amine
CID 105243794
1-(3-cyclopropyl-1-hydrazinylpropyl)-N,N-dimethylcyclopentan-1-amine
CID 105242456
[4-methyl-1-(2-methyloxan-2-yl)pent-4-enyl]hydrazine
CID 105256110
1-[1-hydrazinyl-2-(2-methyl-1,2,4-triazol-3-yl)ethyl]-N,N,4-trimethylcyclohexan-1-amine
CID 105243444

Frequently Asked Questions

What is the IUPAC name of 1-(1-hydrazinyl-4-methylpent-4-enyl)-N,N,4-trimethylcyclohexan-1-amine?
The IUPAC name of 1-(1-hydrazinyl-4-methylpent-4-enyl)-N,N,4-trimethylcyclohexan-1-amine (CID 105243454) is 1-(1-hydrazinyl-4-methylpent-4-enyl)-N,N,4-trimethylcyclohexan-1-amine.
What is the SMILES notation for 1-(1-hydrazinyl-4-methylpent-4-enyl)-N,N,4-trimethylcyclohexan-1-amine?
The canonical SMILES for 1-(1-hydrazinyl-4-methylpent-4-enyl)-N,N,4-trimethylcyclohexan-1-amine is C=C(C)CCC(NN)C1(N(C)C)CCC(C)CC1.
What is the InChIKey of 1-(1-hydrazinyl-4-methylpent-4-enyl)-N,N,4-trimethylcyclohexan-1-amine?
The InChIKey is QLCVMCIYVXUWBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3/c1-12(2)6-7-14(17-16)15(18(4)5)10-8-13(3)9-11-15/h13-14,17H,1,6-11,16H2,2-5H3.
What are the key properties of 1-(1-hydrazinyl-4-methylpent-4-enyl)-N,N,4-trimethylcyclohexan-1-amine?
1-(1-hydrazinyl-4-methylpent-4-enyl)-N,N,4-trimethylcyclohexan-1-amine has a molecular weight of 253.43 g/mol, XLogP of 2.69, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-hydrazinyl-4-methylpent-4-enyl)-N,N,4-trimethylcyclohexan-1-amine is sourced from PubChem (CID 105243454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).