[4-[(2,2-dimethylhydrazinyl)methyl]cyclohexen-1-yl]methanamine

C10H21N3 — CID 146175353

IUPAC[4-[(2,2-dimethylhydrazinyl)methyl]cyclohexen-1-yl]methanamine
SMILESCN(C)NCC1CC=C(CN)CC1
InChIInChI=1S/C10H21N3/c1-13(2)12-8-10-5-3-9(7-11)4-6-10/h3,10,12H,4-8,11H2,1-2H3
InChIKeyYRPVDFODDQXZNS-UHFFFAOYSA-N
MW183.30 g/mol
LogP0.74
Rot. Bonds4

About [4-[(2,2-dimethylhydrazinyl)methyl]cyclohexen-1-yl]methanamine

[4-[(2,2-dimethylhydrazinyl)methyl]cyclohexen-1-yl]methanamine (PubChem CID 146175353) has the molecular formula C10H21N3 and a molecular weight of 183.30 g/mol. Its IUPAC name is [4-[(2,2-dimethylhydrazinyl)methyl]cyclohexen-1-yl]methanamine.

Molecular Properties

Compound Name[4-[(2,2-dimethylhydrazinyl)methyl]cyclohexen-1-yl]methanamine
PubChem CID146175353
Molecular FormulaC10H21N3
Molecular Weight183.30 g/mol
Exact Mass183.17
IUPAC Name[4-[(2,2-dimethylhydrazinyl)methyl]cyclohexen-1-yl]methanamine
SMILESCN(C)NCC1CC=C(CN)CC1
InChIInChI=1S/C10H21N3/c1-13(2)12-8-10-5-3-9(7-11)4-6-10/h3,10,12H,4-8,11H2,1-2H3
InChIKeyYRPVDFODDQXZNS-UHFFFAOYSA-N
XLogP0.74
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.30
LogP ≤ 50.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [4-[(2,2-dimethylhydrazinyl)methyl]cyclohexen-1-yl]methanamine?
The IUPAC name of [4-[(2,2-dimethylhydrazinyl)methyl]cyclohexen-1-yl]methanamine (CID 146175353) is [4-[(2,2-dimethylhydrazinyl)methyl]cyclohexen-1-yl]methanamine.
What is the SMILES notation for [4-[(2,2-dimethylhydrazinyl)methyl]cyclohexen-1-yl]methanamine?
The canonical SMILES for [4-[(2,2-dimethylhydrazinyl)methyl]cyclohexen-1-yl]methanamine is CN(C)NCC1CC=C(CN)CC1.
What is the InChIKey of [4-[(2,2-dimethylhydrazinyl)methyl]cyclohexen-1-yl]methanamine?
The InChIKey is YRPVDFODDQXZNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3/c1-13(2)12-8-10-5-3-9(7-11)4-6-10/h3,10,12H,4-8,11H2,1-2H3.
What are the key properties of [4-[(2,2-dimethylhydrazinyl)methyl]cyclohexen-1-yl]methanamine?
[4-[(2,2-dimethylhydrazinyl)methyl]cyclohexen-1-yl]methanamine has a molecular weight of 183.30 g/mol, XLogP of 0.74, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(2,2-dimethylhydrazinyl)methyl]cyclohexen-1-yl]methanamine is sourced from PubChem (CID 146175353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).