methyl-[1-(3-methylidenecyclohexyl)ethyl]azanide

C10H18N- — CID 90876385

IUPACmethyl-[1-(3-methylidenecyclohexyl)ethyl]azanide
SMILESC=C1CCCC(C(C)[N-]C)C1
InChIInChI=1S/C10H18N/c1-8-5-4-6-10(7-8)9(2)11-3/h9-10H,1,4-7H2,2-3H3/q-1
InChIKeyKEYNAAVHYWALPW-UHFFFAOYSA-N
MW152.26 g/mol
LogP3.12
Rot. Bonds2

About methyl-[1-(3-methylidenecyclohexyl)ethyl]azanide

methyl-[1-(3-methylidenecyclohexyl)ethyl]azanide (PubChem CID 90876385) has the molecular formula C10H18N- and a molecular weight of 152.26 g/mol. Its IUPAC name is methyl-[1-(3-methylidenecyclohexyl)ethyl]azanide.

Molecular Properties

Compound Namemethyl-[1-(3-methylidenecyclohexyl)ethyl]azanide
PubChem CID90876385
Molecular FormulaC10H18N-
Molecular Weight152.26 g/mol
Exact Mass152.14
IUPAC Namemethyl-[1-(3-methylidenecyclohexyl)ethyl]azanide
SMILESC=C1CCCC(C(C)[N-]C)C1
InChIInChI=1S/C10H18N/c1-8-5-4-6-10(7-8)9(2)11-3/h9-10H,1,4-7H2,2-3H3/q-1
InChIKeyKEYNAAVHYWALPW-UHFFFAOYSA-N
XLogP3.12
TPSA14.10 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.26
LogP ≤ 53.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of methyl-[1-(3-methylidenecyclohexyl)ethyl]azanide?
The IUPAC name of methyl-[1-(3-methylidenecyclohexyl)ethyl]azanide (CID 90876385) is methyl-[1-(3-methylidenecyclohexyl)ethyl]azanide.
What is the SMILES notation for methyl-[1-(3-methylidenecyclohexyl)ethyl]azanide?
The canonical SMILES for methyl-[1-(3-methylidenecyclohexyl)ethyl]azanide is C=C1CCCC(C(C)[N-]C)C1.
What is the InChIKey of methyl-[1-(3-methylidenecyclohexyl)ethyl]azanide?
The InChIKey is KEYNAAVHYWALPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N/c1-8-5-4-6-10(7-8)9(2)11-3/h9-10H,1,4-7H2,2-3H3/q-1.
What are the key properties of methyl-[1-(3-methylidenecyclohexyl)ethyl]azanide?
methyl-[1-(3-methylidenecyclohexyl)ethyl]azanide has a molecular weight of 152.26 g/mol, XLogP of 3.12, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for methyl-[1-(3-methylidenecyclohexyl)ethyl]azanide is sourced from PubChem (CID 90876385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).