2-ethyl-2-[(4-propan-2-ylmorpholin-2-yl)methylamino]butan-1-ol

C14H30N2O2 — CID 64534914

IUPAC2-ethyl-2-[(4-propan-2-ylmorpholin-2-yl)methylamino]butan-1-ol
SMILESCCC(CC)(CO)NCC1CN(C(C)C)CCO1
InChIInChI=1S/C14H30N2O2/c1-5-14(6-2,11-17)15-9-13-10-16(12(3)4)7-8-18-13/h12-13,15,17H,5-11H2,1-4H3
InChIKeyPALRLQIUCBZZGY-UHFFFAOYSA-N
MW258.41 g/mol
LogP1.24
Rot. Bonds7

About 2-ethyl-2-[(4-propan-2-ylmorpholin-2-yl)methylamino]butan-1-ol

2-ethyl-2-[(4-propan-2-ylmorpholin-2-yl)methylamino]butan-1-ol (PubChem CID 64534914) has the molecular formula C14H30N2O2 and a molecular weight of 258.41 g/mol. Its IUPAC name is 2-ethyl-2-[(4-propan-2-ylmorpholin-2-yl)methylamino]butan-1-ol.

Molecular Properties

Compound Name2-ethyl-2-[(4-propan-2-ylmorpholin-2-yl)methylamino]butan-1-ol
PubChem CID64534914
Molecular FormulaC14H30N2O2
Molecular Weight258.41 g/mol
Exact Mass258.23
IUPAC Name2-ethyl-2-[(4-propan-2-ylmorpholin-2-yl)methylamino]butan-1-ol
SMILESCCC(CC)(CO)NCC1CN(C(C)C)CCO1
InChIInChI=1S/C14H30N2O2/c1-5-14(6-2,11-17)15-9-13-10-16(12(3)4)7-8-18-13/h12-13,15,17H,5-11H2,1-4H3
InChIKeyPALRLQIUCBZZGY-UHFFFAOYSA-N
XLogP1.24
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.41
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-2-[(4-propan-2-ylmorpholin-2-yl)methylamino]butan-1-ol?
The IUPAC name of 2-ethyl-2-[(4-propan-2-ylmorpholin-2-yl)methylamino]butan-1-ol (CID 64534914) is 2-ethyl-2-[(4-propan-2-ylmorpholin-2-yl)methylamino]butan-1-ol.
What is the SMILES notation for 2-ethyl-2-[(4-propan-2-ylmorpholin-2-yl)methylamino]butan-1-ol?
The canonical SMILES for 2-ethyl-2-[(4-propan-2-ylmorpholin-2-yl)methylamino]butan-1-ol is CCC(CC)(CO)NCC1CN(C(C)C)CCO1.
What is the InChIKey of 2-ethyl-2-[(4-propan-2-ylmorpholin-2-yl)methylamino]butan-1-ol?
The InChIKey is PALRLQIUCBZZGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O2/c1-5-14(6-2,11-17)15-9-13-10-16(12(3)4)7-8-18-13/h12-13,15,17H,5-11H2,1-4H3.
What are the key properties of 2-ethyl-2-[(4-propan-2-ylmorpholin-2-yl)methylamino]butan-1-ol?
2-ethyl-2-[(4-propan-2-ylmorpholin-2-yl)methylamino]butan-1-ol has a molecular weight of 258.41 g/mol, XLogP of 1.24, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-2-[(4-propan-2-ylmorpholin-2-yl)methylamino]butan-1-ol is sourced from PubChem (CID 64534914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).