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

C8H17NO2 — CID 103935293

IUPAC(2S)-1-[methyl(oxolan-3-yl)amino]propan-2-ol
SMILESC[C@H](O)CN(C)C1CCOC1
InChIInChI=1S/C8H17NO2/c1-7(10)5-9(2)8-3-4-11-6-8/h7-8,10H,3-6H2,1-2H3/t7-,8?/m0/s1
InChIKeyZDCQETWFVVCJBL-JAMMHHFISA-N
MW159.23 g/mol
LogP0.09
Rot. Bonds3

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

(2S)-1-[methyl(oxolan-3-yl)amino]propan-2-ol (PubChem CID 103935293) has the molecular formula C8H17NO2 and a molecular weight of 159.23 g/mol. Its IUPAC name is (2S)-1-[methyl(oxolan-3-yl)amino]propan-2-ol.

Molecular Properties

Compound Name(2S)-1-[methyl(oxolan-3-yl)amino]propan-2-ol
PubChem CID103935293
Molecular FormulaC8H17NO2
Molecular Weight159.23 g/mol
Exact Mass159.13
IUPAC Name(2S)-1-[methyl(oxolan-3-yl)amino]propan-2-ol
SMILESC[C@H](O)CN(C)C1CCOC1
InChIInChI=1S/C8H17NO2/c1-7(10)5-9(2)8-3-4-11-6-8/h7-8,10H,3-6H2,1-2H3/t7-,8?/m0/s1
InChIKeyZDCQETWFVVCJBL-JAMMHHFISA-N
XLogP0.09
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.23
LogP ≤ 50.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3S)-N-methyl-N-(2-methylpropyl)oxolan-3-amine
CID 171514962
1-[methyl(oxolan-3-yl)amino]pentan-2-ol
CID 82748731
1-(ethylamino)-3-[methyl(oxolan-3-yl)amino]propan-2-ol
CID 82734279
N,2-dimethyl-N-(oxolan-3-yl)butane-1,4-diamine
CID 82740013
4-[methyl(oxolan-3-yl)amino]pentan-2-ol
CID 82748967
2-methyl-3-[methyl(oxolan-3-yl)amino]propanehydrazide
CID 82754042
2-methyl-3-[methyl(oxolan-3-yl)amino]propanimidamide
CID 63558755
1-(2-methoxyethoxy)-3-[methyl(oxolan-3-yl)amino]propan-2-ol
CID 106992193
N,N'-dimethyl-N,N'-bis[(3S)-oxolan-3-yl]but-2-yne-1,4-diamine
CID 124729941
1-[4-(aminomethyl)phenyl]-2-[methyl(oxolan-3-yl)amino]ethanol
CID 82732204
2-methyl-3-[methyl(oxolan-3-yl)amino]-1-phenylpropan-1-one
CID 82743357
N'-methyl-N-(4-methylpentyl)-N'-(oxolan-3-yl)ethane-1,2-diamine
CID 82754643

Frequently Asked Questions

What is the IUPAC name of (2S)-1-[methyl(oxolan-3-yl)amino]propan-2-ol?
The IUPAC name of (2S)-1-[methyl(oxolan-3-yl)amino]propan-2-ol (CID 103935293) is (2S)-1-[methyl(oxolan-3-yl)amino]propan-2-ol.
What is the SMILES notation for (2S)-1-[methyl(oxolan-3-yl)amino]propan-2-ol?
The canonical SMILES for (2S)-1-[methyl(oxolan-3-yl)amino]propan-2-ol is C[C@H](O)CN(C)C1CCOC1.
What is the InChIKey of (2S)-1-[methyl(oxolan-3-yl)amino]propan-2-ol?
The InChIKey is ZDCQETWFVVCJBL-JAMMHHFISA-N. The full InChI is InChI=1S/C8H17NO2/c1-7(10)5-9(2)8-3-4-11-6-8/h7-8,10H,3-6H2,1-2H3/t7-,8?/m0/s1.
What are the key properties of (2S)-1-[methyl(oxolan-3-yl)amino]propan-2-ol?
(2S)-1-[methyl(oxolan-3-yl)amino]propan-2-ol has a molecular weight of 159.23 g/mol, XLogP of 0.09, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-1-[methyl(oxolan-3-yl)amino]propan-2-ol is sourced from PubChem (CID 103935293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).