2-ethyl-2-[[methyl(2-propan-2-yloxyethyl)amino]methyl]butan-1-ol

C13H29NO2 — CID 81074442

IUPAC2-ethyl-2-[[methyl(2-propan-2-yloxyethyl)amino]methyl]butan-1-ol
SMILESCCC(CC)(CO)CN(C)CCOC(C)C
InChIInChI=1S/C13H29NO2/c1-6-13(7-2,11-15)10-14(5)8-9-16-12(3)4/h12,15H,6-11H2,1-5H3
InChIKeyICDZFOGXVAVXDQ-UHFFFAOYSA-N
MW231.38 g/mol
LogP2.14
Rot. Bonds9

About 2-ethyl-2-[[methyl(2-propan-2-yloxyethyl)amino]methyl]butan-1-ol

2-ethyl-2-[[methyl(2-propan-2-yloxyethyl)amino]methyl]butan-1-ol (PubChem CID 81074442) has the molecular formula C13H29NO2 and a molecular weight of 231.38 g/mol. Its IUPAC name is 2-ethyl-2-[[methyl(2-propan-2-yloxyethyl)amino]methyl]butan-1-ol.

Molecular Properties

Compound Name2-ethyl-2-[[methyl(2-propan-2-yloxyethyl)amino]methyl]butan-1-ol
PubChem CID81074442
Molecular FormulaC13H29NO2
Molecular Weight231.38 g/mol
Exact Mass231.22
IUPAC Name2-ethyl-2-[[methyl(2-propan-2-yloxyethyl)amino]methyl]butan-1-ol
SMILESCCC(CC)(CO)CN(C)CCOC(C)C
InChIInChI=1S/C13H29NO2/c1-6-13(7-2,11-15)10-14(5)8-9-16-12(3)4/h12,15H,6-11H2,1-5H3
InChIKeyICDZFOGXVAVXDQ-UHFFFAOYSA-N
XLogP2.14
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.38
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-ethyl-2-[[methyl(2-propan-2-yloxyethyl)amino]methyl]butan-1-ol with MolForge

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Related Compounds

2-ethyl-2-[[methyl(propyl)amino]methyl]butan-1-ol
CID 62270573
2-methyl-2-(methylamino)-3-[methyl(2-propan-2-yloxyethyl)amino]propan-1-ol
CID 81065082
2,2,2-trifluoro-N-methyl-N-(2-propan-2-yloxyethyl)ethanamine
CID 166728027
1-N,2-dimethyl-1-N-(2-propan-2-yloxyethyl)propane-1,2-diamine
CID 81055039
2,2-dimethyl-3-[methyl(2-propan-2-yloxyethyl)amino]propanoic acid
CID 81057064
2-ethyl-2-[[1-methoxypropan-2-yl(methyl)amino]methyl]butan-1-ol
CID 62270584
3-bromo-N,2,2-trimethyl-N-(2-propan-2-yloxyethyl)propan-1-amine
CID 81062792
2-hydroxy-2-methyl-3-[methyl(2-propan-2-yloxyethyl)amino]propanoic acid
CID 81056783
(2S)-1-[methyl(2-propan-2-yloxyethyl)amino]propan-2-ol
CID 103935283
2-cyclopropyl-3-[methyl(2-propan-2-yloxyethyl)amino]-2-(propan-2-ylamino)propan-1-ol
CID 81063258
2-methyl-3-[methyl(2-propan-2-yloxyethyl)amino]propan-1-ol
CID 115665678
2-(ethylamino)-4-[methyl(2-propan-2-yloxyethyl)amino]butan-1-ol
CID 81063410

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-2-[[methyl(2-propan-2-yloxyethyl)amino]methyl]butan-1-ol?
The IUPAC name of 2-ethyl-2-[[methyl(2-propan-2-yloxyethyl)amino]methyl]butan-1-ol (CID 81074442) is 2-ethyl-2-[[methyl(2-propan-2-yloxyethyl)amino]methyl]butan-1-ol.
What is the SMILES notation for 2-ethyl-2-[[methyl(2-propan-2-yloxyethyl)amino]methyl]butan-1-ol?
The canonical SMILES for 2-ethyl-2-[[methyl(2-propan-2-yloxyethyl)amino]methyl]butan-1-ol is CCC(CC)(CO)CN(C)CCOC(C)C.
What is the InChIKey of 2-ethyl-2-[[methyl(2-propan-2-yloxyethyl)amino]methyl]butan-1-ol?
The InChIKey is ICDZFOGXVAVXDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H29NO2/c1-6-13(7-2,11-15)10-14(5)8-9-16-12(3)4/h12,15H,6-11H2,1-5H3.
What are the key properties of 2-ethyl-2-[[methyl(2-propan-2-yloxyethyl)amino]methyl]butan-1-ol?
2-ethyl-2-[[methyl(2-propan-2-yloxyethyl)amino]methyl]butan-1-ol has a molecular weight of 231.38 g/mol, XLogP of 2.14, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-2-[[methyl(2-propan-2-yloxyethyl)amino]methyl]butan-1-ol is sourced from PubChem (CID 81074442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).