N,N-dimethylmethanamine;ethane;methane;2-methylprop-1-ene;propane

C16H43N — CID 158164014

IUPACN,N-dimethylmethanamine;ethane;methane;2-methylprop-1-ene;propane
SMILESC.C=C(C)C.CC.CCC.CCC.CN(C)C
InChIInChI=1S/C4H8.C3H9N.2C3H8.C2H6.CH4/c2*1-4(2)3;2*1-3-2;1-2;/h1H2,2-3H3;1-3H3;2*3H2,1-2H3;1-2H3;1H4
InChIKeyFWPVTOAHOIHIOO-UHFFFAOYSA-N
MW249.53 g/mol
LogP6.26
Rot. Bonds

About N,N-dimethylmethanamine;ethane;methane;2-methylprop-1-ene;propane

N,N-dimethylmethanamine;ethane;methane;2-methylprop-1-ene;propane (PubChem CID 158164014) has the molecular formula C16H43N and a molecular weight of 249.53 g/mol. Its IUPAC name is N,N-dimethylmethanamine;ethane;methane;2-methylprop-1-ene;propane.

Molecular Properties

Compound NameN,N-dimethylmethanamine;ethane;methane;2-methylprop-1-ene;propane
PubChem CID158164014
Molecular FormulaC16H43N
Molecular Weight249.53 g/mol
Exact Mass249.34
IUPAC NameN,N-dimethylmethanamine;ethane;methane;2-methylprop-1-ene;propane
SMILESC.C=C(C)C.CC.CCC.CCC.CN(C)C
InChIInChI=1S/C4H8.C3H9N.2C3H8.C2H6.CH4/c2*1-4(2)3;2*1-3-2;1-2;/h1H2,2-3H3;1-3H3;2*3H2,1-2H3;1-2H3;1H4
InChIKeyFWPVTOAHOIHIOO-UHFFFAOYSA-N
XLogP6.26
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500249.53
LogP ≤ 56.26
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-dimethylmethanamine;ethane;methane;2-methylprop-1-ene;propane?
The IUPAC name of N,N-dimethylmethanamine;ethane;methane;2-methylprop-1-ene;propane (CID 158164014) is N,N-dimethylmethanamine;ethane;methane;2-methylprop-1-ene;propane.
What is the SMILES notation for N,N-dimethylmethanamine;ethane;methane;2-methylprop-1-ene;propane?
The canonical SMILES for N,N-dimethylmethanamine;ethane;methane;2-methylprop-1-ene;propane is C.C=C(C)C.CC.CCC.CCC.CN(C)C.
What is the InChIKey of N,N-dimethylmethanamine;ethane;methane;2-methylprop-1-ene;propane?
The InChIKey is FWPVTOAHOIHIOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8.C3H9N.2C3H8.C2H6.CH4/c2*1-4(2)3;2*1-3-2;1-2;/h1H2,2-3H3;1-3H3;2*3H2,1-2H3;1-2H3;1H4.
What are the key properties of N,N-dimethylmethanamine;ethane;methane;2-methylprop-1-ene;propane?
N,N-dimethylmethanamine;ethane;methane;2-methylprop-1-ene;propane has a molecular weight of 249.53 g/mol, XLogP of 6.26, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethylmethanamine;ethane;methane;2-methylprop-1-ene;propane is sourced from PubChem (CID 158164014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).