N,N-dimethylmethanamine;methane;2-methylpropane;2-methylprop-1-ene

C14H39N — CID 159601592

IUPACN,N-dimethylmethanamine;methane;2-methylpropane;2-methylprop-1-ene
SMILESC.C.C.C=C(C)C.CC(C)C.CN(C)C
InChIInChI=1S/C4H10.C4H8.C3H9N.3CH4/c3*1-4(2)3;;;/h4H,1-3H3;1H2,2-3H3;1-3H3;3*1H4
InChIKeyMLNZBKNGBVECMS-UHFFFAOYSA-N
MW221.47 g/mol
LogP5.33
Rot. Bonds

About N,N-dimethylmethanamine;methane;2-methylpropane;2-methylprop-1-ene

N,N-dimethylmethanamine;methane;2-methylpropane;2-methylprop-1-ene (PubChem CID 159601592) has the molecular formula C14H39N and a molecular weight of 221.47 g/mol. Its IUPAC name is N,N-dimethylmethanamine;methane;2-methylpropane;2-methylprop-1-ene.

Molecular Properties

Compound NameN,N-dimethylmethanamine;methane;2-methylpropane;2-methylprop-1-ene
PubChem CID159601592
Molecular FormulaC14H39N
Molecular Weight221.47 g/mol
Exact Mass221.31
IUPAC NameN,N-dimethylmethanamine;methane;2-methylpropane;2-methylprop-1-ene
SMILESC.C.C.C=C(C)C.CC(C)C.CN(C)C
InChIInChI=1S/C4H10.C4H8.C3H9N.3CH4/c3*1-4(2)3;;;/h4H,1-3H3;1H2,2-3H3;1-3H3;3*1H4
InChIKeyMLNZBKNGBVECMS-UHFFFAOYSA-N
XLogP5.33
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500221.47
LogP ≤ 55.33
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;methane;2-methylpropane;2-methylprop-1-ene?
The IUPAC name of N,N-dimethylmethanamine;methane;2-methylpropane;2-methylprop-1-ene (CID 159601592) is N,N-dimethylmethanamine;methane;2-methylpropane;2-methylprop-1-ene.
What is the SMILES notation for N,N-dimethylmethanamine;methane;2-methylpropane;2-methylprop-1-ene?
The canonical SMILES for N,N-dimethylmethanamine;methane;2-methylpropane;2-methylprop-1-ene is C.C.C.C=C(C)C.CC(C)C.CN(C)C.
What is the InChIKey of N,N-dimethylmethanamine;methane;2-methylpropane;2-methylprop-1-ene?
The InChIKey is MLNZBKNGBVECMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10.C4H8.C3H9N.3CH4/c3*1-4(2)3;;;/h4H,1-3H3;1H2,2-3H3;1-3H3;3*1H4.
What are the key properties of N,N-dimethylmethanamine;methane;2-methylpropane;2-methylprop-1-ene?
N,N-dimethylmethanamine;methane;2-methylpropane;2-methylprop-1-ene has a molecular weight of 221.47 g/mol, XLogP of 5.33, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethylmethanamine;methane;2-methylpropane;2-methylprop-1-ene is sourced from PubChem (CID 159601592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).