2-[methyl(propyl)amino]-1-(oxolan-3-yl)ethanol

C10H21NO2 — CID 104752489

IUPAC2-[methyl(propyl)amino]-1-(oxolan-3-yl)ethanol
SMILESCCCN(C)CC(O)C1CCOC1
InChIInChI=1S/C10H21NO2/c1-3-5-11(2)7-10(12)9-4-6-13-8-9/h9-10,12H,3-8H2,1-2H3
InChIKeyNZKPVYJEAVSYJN-UHFFFAOYSA-N
MW187.28 g/mol
LogP0.73
Rot. Bonds5

About 2-[methyl(propyl)amino]-1-(oxolan-3-yl)ethanol

2-[methyl(propyl)amino]-1-(oxolan-3-yl)ethanol (PubChem CID 104752489) has the molecular formula C10H21NO2 and a molecular weight of 187.28 g/mol. Its IUPAC name is 2-[methyl(propyl)amino]-1-(oxolan-3-yl)ethanol.

Molecular Properties

Compound Name2-[methyl(propyl)amino]-1-(oxolan-3-yl)ethanol
PubChem CID104752489
Molecular FormulaC10H21NO2
Molecular Weight187.28 g/mol
Exact Mass187.16
IUPAC Name2-[methyl(propyl)amino]-1-(oxolan-3-yl)ethanol
SMILESCCCN(C)CC(O)C1CCOC1
InChIInChI=1S/C10H21NO2/c1-3-5-11(2)7-10(12)9-4-6-13-8-9/h9-10,12H,3-8H2,1-2H3
InChIKeyNZKPVYJEAVSYJN-UHFFFAOYSA-N
XLogP0.73
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.28
LogP ≤ 50.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[butyl(methyl)amino]-1-(oxolan-3-yl)ethanol
CID 104752432
2-[methyl(pentyl)amino]-1-(oxolan-3-yl)ethanol
CID 104752525
2-[3-methoxypropyl(methyl)amino]-1-(oxolan-3-yl)ethanol
CID 104752833
N'-methyl-1-(oxolan-3-yl)-N'-propylethane-1,2-diamine
CID 104744694
2-[2-(cyclopropylmethoxy)ethyl-methylamino]-1-(oxolan-3-yl)ethanol
CID 104753034
1-(oxolan-3-yl)-2-[propyl(2,2,2-trifluoroethyl)amino]ethanol
CID 104752605
2-[cyclohexyl(methyl)amino]-1-(oxolan-3-yl)ethanol
CID 104752424
2-(dimethylamino)-1-(oxan-3-yl)ethanol
CID 107136154
(1S)-2-amino-1-[(3R)-oxolan-3-yl]ethanol
CID 93046962
2-[2-methylpropyl(propan-2-yl)amino]-1-(oxolan-3-yl)ethanol
CID 104752686
2-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-1-(oxolan-3-yl)ethanol
CID 113449126
2-[butan-2-yl(2-methoxyethyl)amino]-1-(oxolan-3-yl)ethanol
CID 113449128

Frequently Asked Questions

What is the IUPAC name of 2-[methyl(propyl)amino]-1-(oxolan-3-yl)ethanol?
The IUPAC name of 2-[methyl(propyl)amino]-1-(oxolan-3-yl)ethanol (CID 104752489) is 2-[methyl(propyl)amino]-1-(oxolan-3-yl)ethanol.
What is the SMILES notation for 2-[methyl(propyl)amino]-1-(oxolan-3-yl)ethanol?
The canonical SMILES for 2-[methyl(propyl)amino]-1-(oxolan-3-yl)ethanol is CCCN(C)CC(O)C1CCOC1.
What is the InChIKey of 2-[methyl(propyl)amino]-1-(oxolan-3-yl)ethanol?
The InChIKey is NZKPVYJEAVSYJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2/c1-3-5-11(2)7-10(12)9-4-6-13-8-9/h9-10,12H,3-8H2,1-2H3.
What are the key properties of 2-[methyl(propyl)amino]-1-(oxolan-3-yl)ethanol?
2-[methyl(propyl)amino]-1-(oxolan-3-yl)ethanol has a molecular weight of 187.28 g/mol, XLogP of 0.73, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl(propyl)amino]-1-(oxolan-3-yl)ethanol is sourced from PubChem (CID 104752489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).