methanamine;2-methylbutan-2-ol

C6H17NO — CID 142079467

IUPACmethanamine;2-methylbutan-2-ol
SMILESCCC(C)(C)O.CN
InChIInChI=1S/C5H12O.CH5N/c1-4-5(2,3)6;1-2/h6H,4H2,1-3H3;2H2,1H3
InChIKeyOPJHCBXBNYQTMD-UHFFFAOYSA-N
MW119.21 g/mol
LogP0.74
Rot. Bonds1

About methanamine;2-methylbutan-2-ol

methanamine;2-methylbutan-2-ol (PubChem CID 142079467) has the molecular formula C6H17NO and a molecular weight of 119.21 g/mol. Its IUPAC name is methanamine;2-methylbutan-2-ol.

Molecular Properties

Compound Namemethanamine;2-methylbutan-2-ol
PubChem CID142079467
Molecular FormulaC6H17NO
Molecular Weight119.21 g/mol
Exact Mass119.13
IUPAC Namemethanamine;2-methylbutan-2-ol
SMILESCCC(C)(C)O.CN
InChIInChI=1S/C5H12O.CH5N/c1-4-5(2,3)6;1-2/h6H,4H2,1-3H3;2H2,1H3
InChIKeyOPJHCBXBNYQTMD-UHFFFAOYSA-N
XLogP0.74
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500119.21
LogP ≤ 50.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

sodium;hydride;bis(2-methylbutan-2-ol)
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2-aminobutan-2-ol;propane
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1-amino-2-methylpropan-2-ol;ethanol;tantalum
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2-aminobutan-2-ol;N-methylmethanamine
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CID 173005032
hafnium;3-methylpentan-3-ol
CID 154175223
(2S)-2-iodobutan-2-ol
CID 126611697
azane;3-methylpentan-3-ol
CID 87107560
3,3-dimethylpentane;ethane;methanol
CID 144527462
4-(aminomethyl)-2,4-dimethylhexan-2-ol
CID 89363832

Frequently Asked Questions

What is the IUPAC name of methanamine;2-methylbutan-2-ol?
The IUPAC name of methanamine;2-methylbutan-2-ol (CID 142079467) is methanamine;2-methylbutan-2-ol.
What is the SMILES notation for methanamine;2-methylbutan-2-ol?
The canonical SMILES for methanamine;2-methylbutan-2-ol is CCC(C)(C)O.CN.
What is the InChIKey of methanamine;2-methylbutan-2-ol?
The InChIKey is OPJHCBXBNYQTMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12O.CH5N/c1-4-5(2,3)6;1-2/h6H,4H2,1-3H3;2H2,1H3.
What are the key properties of methanamine;2-methylbutan-2-ol?
methanamine;2-methylbutan-2-ol has a molecular weight of 119.21 g/mol, XLogP of 0.74, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methanamine;2-methylbutan-2-ol is sourced from PubChem (CID 142079467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).