1-(1-hydrazinyloct-7-enyl)-N,N,3-trimethylcyclohexan-1-amine

C17H35N3 — CID 107012549

IUPAC1-(1-hydrazinyloct-7-enyl)-N,N,3-trimethylcyclohexan-1-amine
SMILESC=CCCCCCC(NN)C1(N(C)C)CCCC(C)C1
InChIInChI=1S/C17H35N3/c1-5-6-7-8-9-12-16(19-18)17(20(3)4)13-10-11-15(2)14-17/h5,15-16,19H,1,6-14,18H2,2-4H3
InChIKeyTVPKQQXMTIPILN-UHFFFAOYSA-N
MW281.49 g/mol
LogP3.47
Rot. Bonds9

About 1-(1-hydrazinyloct-7-enyl)-N,N,3-trimethylcyclohexan-1-amine

1-(1-hydrazinyloct-7-enyl)-N,N,3-trimethylcyclohexan-1-amine (PubChem CID 107012549) has the molecular formula C17H35N3 and a molecular weight of 281.49 g/mol. Its IUPAC name is 1-(1-hydrazinyloct-7-enyl)-N,N,3-trimethylcyclohexan-1-amine.

Molecular Properties

Compound Name1-(1-hydrazinyloct-7-enyl)-N,N,3-trimethylcyclohexan-1-amine
PubChem CID107012549
Molecular FormulaC17H35N3
Molecular Weight281.49 g/mol
Exact Mass281.28
IUPAC Name1-(1-hydrazinyloct-7-enyl)-N,N,3-trimethylcyclohexan-1-amine
SMILESC=CCCCCCC(NN)C1(N(C)C)CCCC(C)C1
InChIInChI=1S/C17H35N3/c1-5-6-7-8-9-12-16(19-18)17(20(3)4)13-10-11-15(2)14-17/h5,15-16,19H,1,6-14,18H2,2-4H3
InChIKeyTVPKQQXMTIPILN-UHFFFAOYSA-N
XLogP3.47
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.49
LogP ≤ 53.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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

N,N,3-trimethyl-1-[1-(methylamino)hex-5-enyl]cyclohexan-1-amine
CID 79074031
1-(1-aminopent-4-enyl)-N,N,3-trimethylcyclohexan-1-amine
CID 79074099
1-(1-aminoprop-2-enyl)-N,N,3-trimethylcyclohexan-1-amine
CID 79074167
N,N,3-trimethyl-1-[1-(methylamino)pent-4-enyl]cyclohexan-1-amine
CID 79074256
1-[1-(ethylamino)pent-4-enyl]-N,N,3-trimethylcyclohexan-1-amine
CID 79074333
N,N,3-trimethyl-1-[1-(propylamino)hex-5-enyl]cyclohexan-1-amine
CID 79074335
1-(1-aminohex-5-enyl)-N,N,3-trimethylcyclohexan-1-amine
CID 79074618
N,N,3-trimethyl-1-[1-(methylamino)but-3-enyl]cyclohexan-1-amine
CID 79074840
1-[1-(ethylamino)hex-5-enyl]-N,N,3-trimethylcyclohexan-1-amine
CID 79074845
N,N,3-trimethyl-1-[1-(propylamino)but-3-enyl]cyclohexan-1-amine
CID 79074848
1-(1-aminobut-3-enyl)-N,N,3-trimethylcyclohexan-1-amine
CID 79075063
N,N,3-trimethyl-1-[1-(propylamino)pent-4-enyl]cyclohexan-1-amine
CID 79075148

Frequently Asked Questions

What is the IUPAC name of 1-(1-hydrazinyloct-7-enyl)-N,N,3-trimethylcyclohexan-1-amine?
The IUPAC name of 1-(1-hydrazinyloct-7-enyl)-N,N,3-trimethylcyclohexan-1-amine (CID 107012549) is 1-(1-hydrazinyloct-7-enyl)-N,N,3-trimethylcyclohexan-1-amine.
What is the SMILES notation for 1-(1-hydrazinyloct-7-enyl)-N,N,3-trimethylcyclohexan-1-amine?
The canonical SMILES for 1-(1-hydrazinyloct-7-enyl)-N,N,3-trimethylcyclohexan-1-amine is C=CCCCCCC(NN)C1(N(C)C)CCCC(C)C1.
What is the InChIKey of 1-(1-hydrazinyloct-7-enyl)-N,N,3-trimethylcyclohexan-1-amine?
The InChIKey is TVPKQQXMTIPILN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H35N3/c1-5-6-7-8-9-12-16(19-18)17(20(3)4)13-10-11-15(2)14-17/h5,15-16,19H,1,6-14,18H2,2-4H3.
What are the key properties of 1-(1-hydrazinyloct-7-enyl)-N,N,3-trimethylcyclohexan-1-amine?
1-(1-hydrazinyloct-7-enyl)-N,N,3-trimethylcyclohexan-1-amine has a molecular weight of 281.49 g/mol, XLogP of 3.47, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-hydrazinyloct-7-enyl)-N,N,3-trimethylcyclohexan-1-amine is sourced from PubChem (CID 107012549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).