[2-(3-cyclohexylprop-1-enyl)hydrazinyl]methanediamine

C10H22N4 — CID 7007676

IUPAC[2-(3-cyclohexylprop-1-enyl)hydrazinyl]methanediamine
SMILESNC(N)NNC=CCC1CCCCC1
InChIInChI=1S/C10H22N4/c11-10(12)14-13-8-4-7-9-5-2-1-3-6-9/h4,8-10,13-14H,1-3,5-7,11-12H2
InChIKeyOLNZFCDDNABICO-UHFFFAOYSA-N
MW198.31 g/mol
LogP0.77
Rot. Bonds5

About [2-(3-cyclohexylprop-1-enyl)hydrazinyl]methanediamine

[2-(3-cyclohexylprop-1-enyl)hydrazinyl]methanediamine (PubChem CID 7007676) has the molecular formula C10H22N4 and a molecular weight of 198.31 g/mol. Its IUPAC name is [2-(3-cyclohexylprop-1-enyl)hydrazinyl]methanediamine.

Molecular Properties

Compound Name[2-(3-cyclohexylprop-1-enyl)hydrazinyl]methanediamine
PubChem CID7007676
Molecular FormulaC10H22N4
Molecular Weight198.31 g/mol
Exact Mass198.18
IUPAC Name[2-(3-cyclohexylprop-1-enyl)hydrazinyl]methanediamine
SMILESNC(N)NNC=CCC1CCCCC1
InChIInChI=1S/C10H22N4/c11-10(12)14-13-8-4-7-9-5-2-1-3-6-9/h4,8-10,13-14H,1-3,5-7,11-12H2
InChIKeyOLNZFCDDNABICO-UHFFFAOYSA-N
XLogP0.77
TPSA76.10 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 50.77
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', '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 [2-(3-cyclohexylprop-1-enyl)hydrazinyl]methanediamine?
The IUPAC name of [2-(3-cyclohexylprop-1-enyl)hydrazinyl]methanediamine (CID 7007676) is [2-(3-cyclohexylprop-1-enyl)hydrazinyl]methanediamine.
What is the SMILES notation for [2-(3-cyclohexylprop-1-enyl)hydrazinyl]methanediamine?
The canonical SMILES for [2-(3-cyclohexylprop-1-enyl)hydrazinyl]methanediamine is NC(N)NNC=CCC1CCCCC1.
What is the InChIKey of [2-(3-cyclohexylprop-1-enyl)hydrazinyl]methanediamine?
The InChIKey is OLNZFCDDNABICO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N4/c11-10(12)14-13-8-4-7-9-5-2-1-3-6-9/h4,8-10,13-14H,1-3,5-7,11-12H2.
What are the key properties of [2-(3-cyclohexylprop-1-enyl)hydrazinyl]methanediamine?
[2-(3-cyclohexylprop-1-enyl)hydrazinyl]methanediamine has a molecular weight of 198.31 g/mol, XLogP of 0.77, 5 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3-cyclohexylprop-1-enyl)hydrazinyl]methanediamine is sourced from PubChem (CID 7007676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).