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

C8H17NO2 — CID 115773290

IUPAC2-[methyl(oxolan-3-yl)amino]propan-1-ol
SMILESCC(CO)N(C)C1CCOC1
InChIInChI=1S/C8H17NO2/c1-7(5-10)9(2)8-3-4-11-6-8/h7-8,10H,3-6H2,1-2H3
InChIKeyNGFLMVHUWWBPGM-UHFFFAOYSA-N
MW159.23 g/mol
LogP0.09
Rot. Bonds3

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

2-[methyl(oxolan-3-yl)amino]propan-1-ol (PubChem CID 115773290) has the molecular formula C8H17NO2 and a molecular weight of 159.23 g/mol. Its IUPAC name is 2-[methyl(oxolan-3-yl)amino]propan-1-ol.

Molecular Properties

Compound Name2-[methyl(oxolan-3-yl)amino]propan-1-ol
PubChem CID115773290
Molecular FormulaC8H17NO2
Molecular Weight159.23 g/mol
Exact Mass159.13
IUPAC Name2-[methyl(oxolan-3-yl)amino]propan-1-ol
SMILESCC(CO)N(C)C1CCOC1
InChIInChI=1S/C8H17NO2/c1-7(5-10)9(2)8-3-4-11-6-8/h7-8,10H,3-6H2,1-2H3
InChIKeyNGFLMVHUWWBPGM-UHFFFAOYSA-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

2-[methyl(oxan-3-yl)amino]propan-1-ol
CID 103857883
4-[methyl(oxolan-3-yl)amino]pentan-2-ol
CID 82748967
3-N-methyl-3-N-(oxolan-3-yl)butane-1,3-diamine
CID 63556588
1-N,2-N-dimethyl-2-N-(oxolan-3-yl)propane-1,2-diamine
CID 82753910
3-[methyl(oxolan-3-yl)amino]butanethioamide
CID 63557973
1-N-cyclopropyl-2-N-methyl-2-N-(oxolan-3-yl)propane-1,2-diamine
CID 82754795
4-methyl-2-[methyl(oxolan-3-yl)amino]pentanoic acid
CID 110838535
(2S)-1-[methyl(oxolan-3-yl)amino]propan-2-ol
CID 103935293
2-N-methyl-2-N-(oxolan-3-yl)-1-N-(2,2,2-trifluoroethyl)propane-1,2-diamine
CID 82753840
2-[1-[methyl(oxolan-3-yl)amino]ethyl]benzene-1,3-diol
CID 107712028
(3S)-N-methyl-N-(2-methylpropyl)oxolan-3-amine
CID 171514962
3-N,2-dimethyl-3-N-(oxolan-3-yl)-1-N-propylbutane-1,3-diamine
CID 82754797

Frequently Asked Questions

What is the IUPAC name of 2-[methyl(oxolan-3-yl)amino]propan-1-ol?
The IUPAC name of 2-[methyl(oxolan-3-yl)amino]propan-1-ol (CID 115773290) is 2-[methyl(oxolan-3-yl)amino]propan-1-ol.
What is the SMILES notation for 2-[methyl(oxolan-3-yl)amino]propan-1-ol?
The canonical SMILES for 2-[methyl(oxolan-3-yl)amino]propan-1-ol is CC(CO)N(C)C1CCOC1.
What is the InChIKey of 2-[methyl(oxolan-3-yl)amino]propan-1-ol?
The InChIKey is NGFLMVHUWWBPGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO2/c1-7(5-10)9(2)8-3-4-11-6-8/h7-8,10H,3-6H2,1-2H3.
What are the key properties of 2-[methyl(oxolan-3-yl)amino]propan-1-ol?
2-[methyl(oxolan-3-yl)amino]propan-1-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 2-[methyl(oxolan-3-yl)amino]propan-1-ol is sourced from PubChem (CID 115773290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).