bis(N-methylmethanamine);phenol

C10H20N2O — CID 159670069

IUPACbis(N-methylmethanamine);phenol
SMILESCNC.CNC.Oc1ccccc1
InChIInChI=1S/C6H6O.2C2H7N/c7-6-4-2-1-3-5-6;2*1-3-2/h1-5,7H;2*3H,1-2H3
InChIKeyMTWSBVCOIHIUPA-UHFFFAOYSA-N
MW184.28 g/mol
LogP1.06
Rot. Bonds

About bis(N-methylmethanamine);phenol

bis(N-methylmethanamine);phenol (PubChem CID 159670069) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is bis(N-methylmethanamine);phenol.

Molecular Properties

Compound Namebis(N-methylmethanamine);phenol
PubChem CID159670069
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Namebis(N-methylmethanamine);phenol
SMILESCNC.CNC.Oc1ccccc1
InChIInChI=1S/C6H6O.2C2H7N/c7-6-4-2-1-3-5-6;2*1-3-2/h1-5,7H;2*3H,1-2H3
InChIKeyMTWSBVCOIHIUPA-UHFFFAOYSA-N
XLogP1.06
TPSA44.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 51.06
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of bis(N-methylmethanamine);phenol?
The IUPAC name of bis(N-methylmethanamine);phenol (CID 159670069) is bis(N-methylmethanamine);phenol.
What is the SMILES notation for bis(N-methylmethanamine);phenol?
The canonical SMILES for bis(N-methylmethanamine);phenol is CNC.CNC.Oc1ccccc1.
What is the InChIKey of bis(N-methylmethanamine);phenol?
The InChIKey is MTWSBVCOIHIUPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6O.2C2H7N/c7-6-4-2-1-3-5-6;2*1-3-2/h1-5,7H;2*3H,1-2H3.
What are the key properties of bis(N-methylmethanamine);phenol?
bis(N-methylmethanamine);phenol has a molecular weight of 184.28 g/mol, XLogP of 1.06, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for bis(N-methylmethanamine);phenol is sourced from PubChem (CID 159670069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).