2-[[2-[ethyl(methyl)amino]ethylamino]methyl]-2-methylbutan-1-ol

C11H26N2O — CID 81419046

IUPAC2-[[2-[ethyl(methyl)amino]ethylamino]methyl]-2-methylbutan-1-ol
SMILESCCN(C)CCNCC(C)(CC)CO
InChIInChI=1S/C11H26N2O/c1-5-11(3,10-14)9-12-7-8-13(4)6-2/h12,14H,5-10H2,1-4H3
InChIKeySCPBYCUFAAJFHF-UHFFFAOYSA-N
MW202.34 g/mol
LogP0.94
Rot. Bonds8

About 2-[[2-[ethyl(methyl)amino]ethylamino]methyl]-2-methylbutan-1-ol

2-[[2-[ethyl(methyl)amino]ethylamino]methyl]-2-methylbutan-1-ol (PubChem CID 81419046) has the molecular formula C11H26N2O and a molecular weight of 202.34 g/mol. Its IUPAC name is 2-[[2-[ethyl(methyl)amino]ethylamino]methyl]-2-methylbutan-1-ol.

Molecular Properties

Compound Name2-[[2-[ethyl(methyl)amino]ethylamino]methyl]-2-methylbutan-1-ol
PubChem CID81419046
Molecular FormulaC11H26N2O
Molecular Weight202.34 g/mol
Exact Mass202.20
IUPAC Name2-[[2-[ethyl(methyl)amino]ethylamino]methyl]-2-methylbutan-1-ol
SMILESCCN(C)CCNCC(C)(CC)CO
InChIInChI=1S/C11H26N2O/c1-5-11(3,10-14)9-12-7-8-13(4)6-2/h12,14H,5-10H2,1-4H3
InChIKeySCPBYCUFAAJFHF-UHFFFAOYSA-N
XLogP0.94
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.34
LogP ≤ 50.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-methyl-2-[[2-[methyl(propan-2-yl)amino]ethylamino]methyl]butan-1-ol
CID 81419151
2-[(2-aminoethylamino)methyl]-2-methylbutan-1-ol
CID 81418901
3-[2-[[2-(hydroxymethyl)-2-methylbutyl]amino]ethyl]-1,1-dimethylurea
CID 83116818
3-[[2-(hydroxymethyl)-2-methylbutyl]amino]propanenitrile
CID 81413090
N-ethyl-2-[[2-(hydroxymethyl)-2-methylbutyl]amino]-N-methylacetamide
CID 107649223
2-[[2-(hydroxymethyl)-2-methylbutyl]amino]-N,N-dimethylacetamide
CID 81412798
2-methyl-2-[(5-methylhexylamino)methyl]butan-1-ol
CID 115324505
(2R)-2-[[[(3R,4R)-4-amino-3-methylpentyl]amino]methyl]-2-methylbutan-1-ol
CID 87167758
2-[[[2-(dimethylamino)-3-ethylpentyl]amino]methyl]-2-methylbutan-1-ol
CID 81412557
2-[[2-(2-methoxyethoxy)ethylamino]methyl]-2-methylbutan-1-ol
CID 81418619
3-[[2-(hydroxymethyl)-2-methylbutyl]amino]-N-propylpropanamide
CID 81418525
2-methyl-2-[(3-propan-2-yloxypropylamino)methyl]butan-1-ol
CID 81412865

Frequently Asked Questions

What is the IUPAC name of 2-[[2-[ethyl(methyl)amino]ethylamino]methyl]-2-methylbutan-1-ol?
The IUPAC name of 2-[[2-[ethyl(methyl)amino]ethylamino]methyl]-2-methylbutan-1-ol (CID 81419046) is 2-[[2-[ethyl(methyl)amino]ethylamino]methyl]-2-methylbutan-1-ol.
What is the SMILES notation for 2-[[2-[ethyl(methyl)amino]ethylamino]methyl]-2-methylbutan-1-ol?
The canonical SMILES for 2-[[2-[ethyl(methyl)amino]ethylamino]methyl]-2-methylbutan-1-ol is CCN(C)CCNCC(C)(CC)CO.
What is the InChIKey of 2-[[2-[ethyl(methyl)amino]ethylamino]methyl]-2-methylbutan-1-ol?
The InChIKey is SCPBYCUFAAJFHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26N2O/c1-5-11(3,10-14)9-12-7-8-13(4)6-2/h12,14H,5-10H2,1-4H3.
What are the key properties of 2-[[2-[ethyl(methyl)amino]ethylamino]methyl]-2-methylbutan-1-ol?
2-[[2-[ethyl(methyl)amino]ethylamino]methyl]-2-methylbutan-1-ol has a molecular weight of 202.34 g/mol, XLogP of 0.94, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-[ethyl(methyl)amino]ethylamino]methyl]-2-methylbutan-1-ol is sourced from PubChem (CID 81419046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).