2-methyl-1-(2,2,3-trimethylbutylamino)propan-2-ol

C11H25NO — CID 102670964

IUPAC2-methyl-1-(2,2,3-trimethylbutylamino)propan-2-ol
SMILESCC(C)C(C)(C)CNCC(C)(C)O
InChIInChI=1S/C11H25NO/c1-9(2)10(3,4)7-12-8-11(5,6)13/h9,12-13H,7-8H2,1-6H3
InChIKeyZYNWYTNFWQJYIU-UHFFFAOYSA-N
MW187.33 g/mol
LogP2.03
Rot. Bonds5

About 2-methyl-1-(2,2,3-trimethylbutylamino)propan-2-ol

2-methyl-1-(2,2,3-trimethylbutylamino)propan-2-ol (PubChem CID 102670964) has the molecular formula C11H25NO and a molecular weight of 187.33 g/mol. Its IUPAC name is 2-methyl-1-(2,2,3-trimethylbutylamino)propan-2-ol.

Molecular Properties

Compound Name2-methyl-1-(2,2,3-trimethylbutylamino)propan-2-ol
PubChem CID102670964
Molecular FormulaC11H25NO
Molecular Weight187.33 g/mol
Exact Mass187.19
IUPAC Name2-methyl-1-(2,2,3-trimethylbutylamino)propan-2-ol
SMILESCC(C)C(C)(C)CNCC(C)(C)O
InChIInChI=1S/C11H25NO/c1-9(2)10(3,4)7-12-8-11(5,6)13/h9,12-13H,7-8H2,1-6H3
InChIKeyZYNWYTNFWQJYIU-UHFFFAOYSA-N
XLogP2.03
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.33
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-oxo-N-(2,2,3-trimethylbutyl)acetamide
CID 115166789
ethane;N,2,2,3-tetramethylbutan-1-amine
CID 142529436
ethyl 2-(2,2,3-trimethylbutylamino)acetate
CID 107095555
tert-butyl N-[2-(2,2,3-trimethylbutylamino)ethyl]carbamate
CID 102610042
2-methyl-1-[2-[methyl(propan-2-yl)amino]ethylamino]propan-2-ol
CID 62639944
2-[(2,2,3-trimethylbutylamino)methyl]butanedioic acid
CID 115144686
2-methyl-6-[(2,2,3-trimethylbutylamino)methyl]phenol
CID 102673408
2,2,3-trimethyl-1-(sulfinoamino)butane
CID 89331787
(2R)-2-hydroxy-N-(2-hydroxy-2-methylpropyl)propanamide
CID 131159624
ethane;N-(2-hydroxy-2-methylpropyl)-2-methylpropanamide
CID 145182364
2-methyl-1-(2-sulfanylethylamino)propan-2-ol
CID 55287531
(2S)-4,4,5-trimethylhexan-2-ol
CID 164734993

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(2,2,3-trimethylbutylamino)propan-2-ol?
The IUPAC name of 2-methyl-1-(2,2,3-trimethylbutylamino)propan-2-ol (CID 102670964) is 2-methyl-1-(2,2,3-trimethylbutylamino)propan-2-ol.
What is the SMILES notation for 2-methyl-1-(2,2,3-trimethylbutylamino)propan-2-ol?
The canonical SMILES for 2-methyl-1-(2,2,3-trimethylbutylamino)propan-2-ol is CC(C)C(C)(C)CNCC(C)(C)O.
What is the InChIKey of 2-methyl-1-(2,2,3-trimethylbutylamino)propan-2-ol?
The InChIKey is ZYNWYTNFWQJYIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25NO/c1-9(2)10(3,4)7-12-8-11(5,6)13/h9,12-13H,7-8H2,1-6H3.
What are the key properties of 2-methyl-1-(2,2,3-trimethylbutylamino)propan-2-ol?
2-methyl-1-(2,2,3-trimethylbutylamino)propan-2-ol has a molecular weight of 187.33 g/mol, XLogP of 2.03, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(2,2,3-trimethylbutylamino)propan-2-ol is sourced from PubChem (CID 102670964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).