N,N-dimethylethanamine;methane;2-methylprop-1-ene

C9H23N — CID 158029780

IUPACN,N-dimethylethanamine;methane;2-methylprop-1-ene
SMILESC.C=C(C)C.CCN(C)C
InChIInChI=1S/C4H11N.C4H8.CH4/c1-4-5(2)3;1-4(2)3;/h4H2,1-3H3;1H2,2-3H3;1H4
InChIKeyFHATYMOHYAKECA-UHFFFAOYSA-N
MW145.29 g/mol
LogP2.79
Rot. Bonds1

About N,N-dimethylethanamine;methane;2-methylprop-1-ene

N,N-dimethylethanamine;methane;2-methylprop-1-ene (PubChem CID 158029780) has the molecular formula C9H23N and a molecular weight of 145.29 g/mol. Its IUPAC name is N,N-dimethylethanamine;methane;2-methylprop-1-ene.

Molecular Properties

Compound NameN,N-dimethylethanamine;methane;2-methylprop-1-ene
PubChem CID158029780
Molecular FormulaC9H23N
Molecular Weight145.29 g/mol
Exact Mass145.18
IUPAC NameN,N-dimethylethanamine;methane;2-methylprop-1-ene
SMILESC.C=C(C)C.CCN(C)C
InChIInChI=1S/C4H11N.C4H8.CH4/c1-4-5(2)3;1-4(2)3;/h4H2,1-3H3;1H2,2-3H3;1H4
InChIKeyFHATYMOHYAKECA-UHFFFAOYSA-N
XLogP2.79
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.29
LogP ≤ 52.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 N,N-dimethylethanamine;methane;2-methylprop-1-ene?
The IUPAC name of N,N-dimethylethanamine;methane;2-methylprop-1-ene (CID 158029780) is N,N-dimethylethanamine;methane;2-methylprop-1-ene.
What is the SMILES notation for N,N-dimethylethanamine;methane;2-methylprop-1-ene?
The canonical SMILES for N,N-dimethylethanamine;methane;2-methylprop-1-ene is C.C=C(C)C.CCN(C)C.
What is the InChIKey of N,N-dimethylethanamine;methane;2-methylprop-1-ene?
The InChIKey is FHATYMOHYAKECA-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H11N.C4H8.CH4/c1-4-5(2)3;1-4(2)3;/h4H2,1-3H3;1H2,2-3H3;1H4.
What are the key properties of N,N-dimethylethanamine;methane;2-methylprop-1-ene?
N,N-dimethylethanamine;methane;2-methylprop-1-ene has a molecular weight of 145.29 g/mol, XLogP of 2.79, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethylethanamine;methane;2-methylprop-1-ene is sourced from PubChem (CID 158029780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).