2-[[2,4-dimethyl-5-(propan-2-ylamino)pentan-2-yl]amino]ethanol

C12H28N2O — CID 154962642

IUPAC2-[[2,4-dimethyl-5-(propan-2-ylamino)pentan-2-yl]amino]ethanol
SMILESCC(CNC(C)C)CC(C)(C)NCCO
InChIInChI=1S/C12H28N2O/c1-10(2)13-9-11(3)8-12(4,5)14-6-7-15/h10-11,13-15H,6-9H2,1-5H3
InChIKeyZKAUGXFSFHMUAI-UHFFFAOYSA-N
MW216.37 g/mol
LogP1.37
Rot. Bonds8

About 2-[[2,4-dimethyl-5-(propan-2-ylamino)pentan-2-yl]amino]ethanol

2-[[2,4-dimethyl-5-(propan-2-ylamino)pentan-2-yl]amino]ethanol (PubChem CID 154962642) has the molecular formula C12H28N2O and a molecular weight of 216.37 g/mol. Its IUPAC name is 2-[[2,4-dimethyl-5-(propan-2-ylamino)pentan-2-yl]amino]ethanol.

Molecular Properties

Compound Name2-[[2,4-dimethyl-5-(propan-2-ylamino)pentan-2-yl]amino]ethanol
PubChem CID154962642
Molecular FormulaC12H28N2O
Molecular Weight216.37 g/mol
Exact Mass216.22
IUPAC Name2-[[2,4-dimethyl-5-(propan-2-ylamino)pentan-2-yl]amino]ethanol
SMILESCC(CNC(C)C)CC(C)(C)NCCO
InChIInChI=1S/C12H28N2O/c1-10(2)13-9-11(3)8-12(4,5)14-6-7-15/h10-11,13-15H,6-9H2,1-5H3
InChIKeyZKAUGXFSFHMUAI-UHFFFAOYSA-N
XLogP1.37
TPSA44.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.37
LogP ≤ 51.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-3-(propan-2-ylamino)propan-1-ol
CID 20806708
2-(2-methylpentan-2-ylamino)ethanol
CID 23342156
2-methyl-1-[methyl-[2-methyl-3-(propan-2-ylamino)propyl]amino]propan-2-ol
CID 79390220
2,5,5-trimethyl-N-propan-2-ylhexan-1-amine
CID 62530891
(2R)-2-methyl-N-propan-2-ylbutan-1-amine
CID 28610226
2-methyl-2-(2-methylbutylamino)propan-1-ol
CID 43207248
2,3-dimethyl-4-(propan-2-ylamino)butan-2-ol
CID 87601650
[[2-methyl-6-(propan-2-ylamino)hexan-2-yl]amino]methanol
CID 142399787
2-[[2-methyl-2-(3-methylbutylamino)propyl]amino]ethanol
CID 144849079
2-[(propan-2-ylamino)methyl]propane-1,3-diol
CID 162784969
N-[2-(2-hydroxyethylamino)-2-methylpropyl]formamide
CID 143275696
2-nitroso-N-propan-2-ylpropan-1-amine
CID 22213580

Frequently Asked Questions

What is the IUPAC name of 2-[[2,4-dimethyl-5-(propan-2-ylamino)pentan-2-yl]amino]ethanol?
The IUPAC name of 2-[[2,4-dimethyl-5-(propan-2-ylamino)pentan-2-yl]amino]ethanol (CID 154962642) is 2-[[2,4-dimethyl-5-(propan-2-ylamino)pentan-2-yl]amino]ethanol.
What is the SMILES notation for 2-[[2,4-dimethyl-5-(propan-2-ylamino)pentan-2-yl]amino]ethanol?
The canonical SMILES for 2-[[2,4-dimethyl-5-(propan-2-ylamino)pentan-2-yl]amino]ethanol is CC(CNC(C)C)CC(C)(C)NCCO.
What is the InChIKey of 2-[[2,4-dimethyl-5-(propan-2-ylamino)pentan-2-yl]amino]ethanol?
The InChIKey is ZKAUGXFSFHMUAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H28N2O/c1-10(2)13-9-11(3)8-12(4,5)14-6-7-15/h10-11,13-15H,6-9H2,1-5H3.
What are the key properties of 2-[[2,4-dimethyl-5-(propan-2-ylamino)pentan-2-yl]amino]ethanol?
2-[[2,4-dimethyl-5-(propan-2-ylamino)pentan-2-yl]amino]ethanol has a molecular weight of 216.37 g/mol, XLogP of 1.37, 8 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2,4-dimethyl-5-(propan-2-ylamino)pentan-2-yl]amino]ethanol is sourced from PubChem (CID 154962642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).