2-amino-4-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pentan-1-ol

C11H25NO2 — CID 137472147

IUPAC2-amino-4-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pentan-1-ol
SMILESCC(C)CC(N)(CO)COC(C)(C)C
InChIInChI=1S/C11H25NO2/c1-9(2)6-11(12,7-13)8-14-10(3,4)5/h9,13H,6-8,12H2,1-5H3
InChIKeyCHNNESKBXARYGR-UHFFFAOYSA-N
MW203.33 g/mol
LogP1.54
Rot. Bonds5

About 2-amino-4-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pentan-1-ol

2-amino-4-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pentan-1-ol (PubChem CID 137472147) has the molecular formula C11H25NO2 and a molecular weight of 203.33 g/mol. Its IUPAC name is 2-amino-4-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pentan-1-ol.

Molecular Properties

Compound Name2-amino-4-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pentan-1-ol
PubChem CID137472147
Molecular FormulaC11H25NO2
Molecular Weight203.33 g/mol
Exact Mass203.19
IUPAC Name2-amino-4-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pentan-1-ol
SMILESCC(C)CC(N)(CO)COC(C)(C)C
InChIInChI=1S/C11H25NO2/c1-9(2)6-11(12,7-13)8-14-10(3,4)5/h9,13H,6-8,12H2,1-5H3
InChIKeyCHNNESKBXARYGR-UHFFFAOYSA-N
XLogP1.54
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-4-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pentan-1-ol?
The IUPAC name of 2-amino-4-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pentan-1-ol (CID 137472147) is 2-amino-4-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pentan-1-ol.
What is the SMILES notation for 2-amino-4-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pentan-1-ol?
The canonical SMILES for 2-amino-4-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pentan-1-ol is CC(C)CC(N)(CO)COC(C)(C)C.
What is the InChIKey of 2-amino-4-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pentan-1-ol?
The InChIKey is CHNNESKBXARYGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25NO2/c1-9(2)6-11(12,7-13)8-14-10(3,4)5/h9,13H,6-8,12H2,1-5H3.
What are the key properties of 2-amino-4-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pentan-1-ol?
2-amino-4-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pentan-1-ol has a molecular weight of 203.33 g/mol, XLogP of 1.54, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pentan-1-ol is sourced from PubChem (CID 137472147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).