2-[1-amino-2-methyl-3-(oxolan-3-yl)propan-2-yl]oxyethanol

C10H21NO3 — CID 165493847

IUPAC2-[1-amino-2-methyl-3-(oxolan-3-yl)propan-2-yl]oxyethanol
SMILESCC(CN)(CC1CCOC1)OCCO
InChIInChI=1S/C10H21NO3/c1-10(8-11,14-5-3-12)6-9-2-4-13-7-9/h9,12H,2-8,11H2,1H3
InChIKeyBNHOBBPBCXOLRP-UHFFFAOYSA-N
MW203.28 g/mol
LogP0.14
Rot. Bonds6

About 2-[1-amino-2-methyl-3-(oxolan-3-yl)propan-2-yl]oxyethanol

2-[1-amino-2-methyl-3-(oxolan-3-yl)propan-2-yl]oxyethanol (PubChem CID 165493847) has the molecular formula C10H21NO3 and a molecular weight of 203.28 g/mol. Its IUPAC name is 2-[1-amino-2-methyl-3-(oxolan-3-yl)propan-2-yl]oxyethanol.

Molecular Properties

Compound Name2-[1-amino-2-methyl-3-(oxolan-3-yl)propan-2-yl]oxyethanol
PubChem CID165493847
Molecular FormulaC10H21NO3
Molecular Weight203.28 g/mol
Exact Mass203.15
IUPAC Name2-[1-amino-2-methyl-3-(oxolan-3-yl)propan-2-yl]oxyethanol
SMILESCC(CN)(CC1CCOC1)OCCO
InChIInChI=1S/C10H21NO3/c1-10(8-11,14-5-3-12)6-9-2-4-13-7-9/h9,12H,2-8,11H2,1H3
InChIKeyBNHOBBPBCXOLRP-UHFFFAOYSA-N
XLogP0.14
TPSA64.71 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.28
LogP ≤ 50.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[1-amino-2-methyl-3-(oxolan-3-yl)propan-2-yl]oxyethanol?
The IUPAC name of 2-[1-amino-2-methyl-3-(oxolan-3-yl)propan-2-yl]oxyethanol (CID 165493847) is 2-[1-amino-2-methyl-3-(oxolan-3-yl)propan-2-yl]oxyethanol.
What is the SMILES notation for 2-[1-amino-2-methyl-3-(oxolan-3-yl)propan-2-yl]oxyethanol?
The canonical SMILES for 2-[1-amino-2-methyl-3-(oxolan-3-yl)propan-2-yl]oxyethanol is CC(CN)(CC1CCOC1)OCCO.
What is the InChIKey of 2-[1-amino-2-methyl-3-(oxolan-3-yl)propan-2-yl]oxyethanol?
The InChIKey is BNHOBBPBCXOLRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO3/c1-10(8-11,14-5-3-12)6-9-2-4-13-7-9/h9,12H,2-8,11H2,1H3.
What are the key properties of 2-[1-amino-2-methyl-3-(oxolan-3-yl)propan-2-yl]oxyethanol?
2-[1-amino-2-methyl-3-(oxolan-3-yl)propan-2-yl]oxyethanol has a molecular weight of 203.28 g/mol, XLogP of 0.14, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-amino-2-methyl-3-(oxolan-3-yl)propan-2-yl]oxyethanol is sourced from PubChem (CID 165493847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).