1-[methyl(oxolan-3-yl)amino]pentan-2-ol

C10H21NO2 — CID 82748731

IUPAC1-[methyl(oxolan-3-yl)amino]pentan-2-ol
SMILESCCCC(O)CN(C)C1CCOC1
InChIInChI=1S/C10H21NO2/c1-3-4-10(12)7-11(2)9-5-6-13-8-9/h9-10,12H,3-8H2,1-2H3
InChIKeyOMWDKFVVTBWJKS-UHFFFAOYSA-N
MW187.28 g/mol
LogP0.87
Rot. Bonds5

About 1-[methyl(oxolan-3-yl)amino]pentan-2-ol

1-[methyl(oxolan-3-yl)amino]pentan-2-ol (PubChem CID 82748731) has the molecular formula C10H21NO2 and a molecular weight of 187.28 g/mol. Its IUPAC name is 1-[methyl(oxolan-3-yl)amino]pentan-2-ol.

Molecular Properties

Compound Name1-[methyl(oxolan-3-yl)amino]pentan-2-ol
PubChem CID82748731
Molecular FormulaC10H21NO2
Molecular Weight187.28 g/mol
Exact Mass187.16
IUPAC Name1-[methyl(oxolan-3-yl)amino]pentan-2-ol
SMILESCCCC(O)CN(C)C1CCOC1
InChIInChI=1S/C10H21NO2/c1-3-4-10(12)7-11(2)9-5-6-13-8-9/h9-10,12H,3-8H2,1-2H3
InChIKeyOMWDKFVVTBWJKS-UHFFFAOYSA-N
XLogP0.87
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 ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(ethylamino)-3-[methyl(oxolan-3-yl)amino]propan-2-ol
CID 82734279
(2S)-1-[methyl(oxolan-3-yl)amino]propan-2-ol
CID 103935293
1-(2-methoxyethoxy)-3-[methyl(oxolan-3-yl)amino]propan-2-ol
CID 106992193
(3S)-N-methyl-N-(2-methylpropyl)oxolan-3-amine
CID 171514962
N,2-dimethyl-N-(oxolan-3-yl)butane-1,4-diamine
CID 82740013
N-butyl-N-methyloxolan-3-amine
CID 154189060
4-[2-hydroxy-3-[methyl(oxolan-3-yl)amino]propoxy]benzenecarbothioamide
CID 82736897
1-(tert-butylamino)-3-[methyl(oxan-4-yl)amino]propan-2-ol
CID 115474949
N-ethyl-N'-methyl-N',1-bis(oxolan-3-yl)ethane-1,2-diamine
CID 104746914
6-[methyl(oxan-4-yl)amino]hexan-3-ol
CID 106802302
N,N'-dimethyl-N,N'-bis[(3S)-oxolan-3-yl]but-2-yne-1,4-diamine
CID 124729941
1-(2-ethoxyphenyl)-2-[methyl(oxolan-3-yl)amino]ethanol
CID 82748181

Frequently Asked Questions

What is the IUPAC name of 1-[methyl(oxolan-3-yl)amino]pentan-2-ol?
The IUPAC name of 1-[methyl(oxolan-3-yl)amino]pentan-2-ol (CID 82748731) is 1-[methyl(oxolan-3-yl)amino]pentan-2-ol.
What is the SMILES notation for 1-[methyl(oxolan-3-yl)amino]pentan-2-ol?
The canonical SMILES for 1-[methyl(oxolan-3-yl)amino]pentan-2-ol is CCCC(O)CN(C)C1CCOC1.
What is the InChIKey of 1-[methyl(oxolan-3-yl)amino]pentan-2-ol?
The InChIKey is OMWDKFVVTBWJKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2/c1-3-4-10(12)7-11(2)9-5-6-13-8-9/h9-10,12H,3-8H2,1-2H3.
What are the key properties of 1-[methyl(oxolan-3-yl)amino]pentan-2-ol?
1-[methyl(oxolan-3-yl)amino]pentan-2-ol has a molecular weight of 187.28 g/mol, XLogP of 0.87, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[methyl(oxolan-3-yl)amino]pentan-2-ol is sourced from PubChem (CID 82748731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).