2-methyl-2-(2-methylbutylamino)propan-1-ol

C9H21NO — CID 43207248

IUPAC2-methyl-2-(2-methylbutylamino)propan-1-ol
SMILESCCC(C)CNC(C)(C)CO
InChIInChI=1S/C9H21NO/c1-5-8(2)6-10-9(3,4)7-11/h8,10-11H,5-7H2,1-4H3
InChIKeyYMEJMLMQOLKNHZ-UHFFFAOYSA-N
MW159.27 g/mol
LogP1.39
Rot. Bonds5

About 2-methyl-2-(2-methylbutylamino)propan-1-ol

2-methyl-2-(2-methylbutylamino)propan-1-ol (PubChem CID 43207248) has the molecular formula C9H21NO and a molecular weight of 159.27 g/mol. Its IUPAC name is 2-methyl-2-(2-methylbutylamino)propan-1-ol.

Molecular Properties

Compound Name2-methyl-2-(2-methylbutylamino)propan-1-ol
PubChem CID43207248
Molecular FormulaC9H21NO
Molecular Weight159.27 g/mol
Exact Mass159.16
IUPAC Name2-methyl-2-(2-methylbutylamino)propan-1-ol
SMILESCCC(C)CNC(C)(C)CO
InChIInChI=1S/C9H21NO/c1-5-8(2)6-10-9(3,4)7-11/h8,10-11H,5-7H2,1-4H3
InChIKeyYMEJMLMQOLKNHZ-UHFFFAOYSA-N
XLogP1.39
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.27
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-2-(2-methylbutylamino)propane-1,3-diol
CID 75525332
2-(hydroxymethyl)-2-(2-methylbutylamino)propane-1,3-diol
CID 107850968
2-ethyl-2-(2-methylbutylamino)propane-1,3-diol
CID 103897103
2-(ethylamino)-2-methylpropan-1-ol
CID 15105174
2-(2-methylbutylamino)-2-phenylpropan-1-ol
CID 115687949
2-methyl-N-(2-methylbut-3-en-2-yl)butan-1-amine
CID 101446483
2-[[(2R)-2-methylbutyl]amino]ethanol
CID 24884413
(4R)-2,4-dimethyl-2-(methylamino)hexan-1-ol
CID 88673624
2-methyl-2-[[(2S)-2-methylpentyl]amino]propane-1,3-diol
CID 97358418
2-N-ethyl-2-methyl-1-N-(2-methylbutyl)propane-1,2-diamine
CID 62835035
2-[[(1-hydroxy-2-methylpropan-2-yl)amino]methylamino]-2-methylpropan-1-ol;methane
CID 158688440
2-methyl-2-[2-(methylamino)ethylamino]propan-1-ol
CID 132887947

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-(2-methylbutylamino)propan-1-ol?
The IUPAC name of 2-methyl-2-(2-methylbutylamino)propan-1-ol (CID 43207248) is 2-methyl-2-(2-methylbutylamino)propan-1-ol.
What is the SMILES notation for 2-methyl-2-(2-methylbutylamino)propan-1-ol?
The canonical SMILES for 2-methyl-2-(2-methylbutylamino)propan-1-ol is CCC(C)CNC(C)(C)CO.
What is the InChIKey of 2-methyl-2-(2-methylbutylamino)propan-1-ol?
The InChIKey is YMEJMLMQOLKNHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21NO/c1-5-8(2)6-10-9(3,4)7-11/h8,10-11H,5-7H2,1-4H3.
What are the key properties of 2-methyl-2-(2-methylbutylamino)propan-1-ol?
2-methyl-2-(2-methylbutylamino)propan-1-ol has a molecular weight of 159.27 g/mol, XLogP of 1.39, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-(2-methylbutylamino)propan-1-ol is sourced from PubChem (CID 43207248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).