methyl-[(1R)-1-(3-methylidenecyclohexyl)propyl]azanide

C11H20N- — CID 91383167

IUPACmethyl-[(1R)-1-(3-methylidenecyclohexyl)propyl]azanide
SMILESC=C1CCCC([C@@H](CC)[N-]C)C1
InChIInChI=1S/C11H20N/c1-4-11(12-3)10-7-5-6-9(2)8-10/h10-11H,2,4-8H2,1,3H3/q-1/t10?,11-/m1/s1
InChIKeyIPAKXSZSCYPHQO-RRKGBCIJSA-N
MW166.29 g/mol
LogP3.51
Rot. Bonds3

About methyl-[(1R)-1-(3-methylidenecyclohexyl)propyl]azanide

methyl-[(1R)-1-(3-methylidenecyclohexyl)propyl]azanide (PubChem CID 91383167) has the molecular formula C11H20N- and a molecular weight of 166.29 g/mol. Its IUPAC name is methyl-[(1R)-1-(3-methylidenecyclohexyl)propyl]azanide.

Molecular Properties

Compound Namemethyl-[(1R)-1-(3-methylidenecyclohexyl)propyl]azanide
PubChem CID91383167
Molecular FormulaC11H20N-
Molecular Weight166.29 g/mol
Exact Mass166.16
IUPAC Namemethyl-[(1R)-1-(3-methylidenecyclohexyl)propyl]azanide
SMILESC=C1CCCC([C@@H](CC)[N-]C)C1
InChIInChI=1S/C11H20N/c1-4-11(12-3)10-7-5-6-9(2)8-10/h10-11H,2,4-8H2,1,3H3/q-1/t10?,11-/m1/s1
InChIKeyIPAKXSZSCYPHQO-RRKGBCIJSA-N
XLogP3.51
TPSA14.10 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.29
LogP ≤ 53.51
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-[(1R)-1-(3-methylidenecyclohexyl)propyl]azanide?
The IUPAC name of methyl-[(1R)-1-(3-methylidenecyclohexyl)propyl]azanide (CID 91383167) is methyl-[(1R)-1-(3-methylidenecyclohexyl)propyl]azanide.
What is the SMILES notation for methyl-[(1R)-1-(3-methylidenecyclohexyl)propyl]azanide?
The canonical SMILES for methyl-[(1R)-1-(3-methylidenecyclohexyl)propyl]azanide is C=C1CCCC([C@@H](CC)[N-]C)C1.
What is the InChIKey of methyl-[(1R)-1-(3-methylidenecyclohexyl)propyl]azanide?
The InChIKey is IPAKXSZSCYPHQO-RRKGBCIJSA-N. The full InChI is InChI=1S/C11H20N/c1-4-11(12-3)10-7-5-6-9(2)8-10/h10-11H,2,4-8H2,1,3H3/q-1/t10?,11-/m1/s1.
What are the key properties of methyl-[(1R)-1-(3-methylidenecyclohexyl)propyl]azanide?
methyl-[(1R)-1-(3-methylidenecyclohexyl)propyl]azanide has a molecular weight of 166.29 g/mol, XLogP of 3.51, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for methyl-[(1R)-1-(3-methylidenecyclohexyl)propyl]azanide is sourced from PubChem (CID 91383167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).