[[ethyl(propan-2-yl)amino]methylamino]methanol

C7H18N2O — CID 59875134

IUPAC[[ethyl(propan-2-yl)amino]methylamino]methanol
SMILESCCN(CNCO)C(C)C
InChIInChI=1S/C7H18N2O/c1-4-9(7(2)3)5-8-6-10/h7-8,10H,4-6H2,1-3H3
InChIKeySXBHJERGLZXZDV-UHFFFAOYSA-N
MW146.23 g/mol
LogP0.21
Rot. Bonds5

About [[ethyl(propan-2-yl)amino]methylamino]methanol

[[ethyl(propan-2-yl)amino]methylamino]methanol (PubChem CID 59875134) has the molecular formula C7H18N2O and a molecular weight of 146.23 g/mol. Its IUPAC name is [[ethyl(propan-2-yl)amino]methylamino]methanol.

Molecular Properties

Compound Name[[ethyl(propan-2-yl)amino]methylamino]methanol
PubChem CID59875134
Molecular FormulaC7H18N2O
Molecular Weight146.23 g/mol
Exact Mass146.14
IUPAC Name[[ethyl(propan-2-yl)amino]methylamino]methanol
SMILESCCN(CNCO)C(C)C
InChIInChI=1S/C7H18N2O/c1-4-9(7(2)3)5-8-6-10/h7-8,10H,4-6H2,1-3H3
InChIKeySXBHJERGLZXZDV-UHFFFAOYSA-N
XLogP0.21
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.23
LogP ≤ 50.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [[ethyl(propan-2-yl)amino]methylamino]methanol?
The IUPAC name of [[ethyl(propan-2-yl)amino]methylamino]methanol (CID 59875134) is [[ethyl(propan-2-yl)amino]methylamino]methanol.
What is the SMILES notation for [[ethyl(propan-2-yl)amino]methylamino]methanol?
The canonical SMILES for [[ethyl(propan-2-yl)amino]methylamino]methanol is CCN(CNCO)C(C)C.
What is the InChIKey of [[ethyl(propan-2-yl)amino]methylamino]methanol?
The InChIKey is SXBHJERGLZXZDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H18N2O/c1-4-9(7(2)3)5-8-6-10/h7-8,10H,4-6H2,1-3H3.
What are the key properties of [[ethyl(propan-2-yl)amino]methylamino]methanol?
[[ethyl(propan-2-yl)amino]methylamino]methanol has a molecular weight of 146.23 g/mol, XLogP of 0.21, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [[ethyl(propan-2-yl)amino]methylamino]methanol is sourced from PubChem (CID 59875134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).