2,3-dimethyl-N-(2-propan-2-yloxyethyl)butan-1-amine

C11H25NO — CID 64571150

IUPAC2,3-dimethyl-N-(2-propan-2-yloxyethyl)butan-1-amine
SMILESCC(C)OCCNCC(C)C(C)C
InChIInChI=1S/C11H25NO/c1-9(2)11(5)8-12-6-7-13-10(3)4/h9-12H,6-8H2,1-5H3
InChIKeyQPHSPOQPEDIJGO-UHFFFAOYSA-N
MW187.33 g/mol
LogP2.29
Rot. Bonds7

About 2,3-dimethyl-N-(2-propan-2-yloxyethyl)butan-1-amine

2,3-dimethyl-N-(2-propan-2-yloxyethyl)butan-1-amine (PubChem CID 64571150) has the molecular formula C11H25NO and a molecular weight of 187.33 g/mol. Its IUPAC name is 2,3-dimethyl-N-(2-propan-2-yloxyethyl)butan-1-amine.

Molecular Properties

Compound Name2,3-dimethyl-N-(2-propan-2-yloxyethyl)butan-1-amine
PubChem CID64571150
Molecular FormulaC11H25NO
Molecular Weight187.33 g/mol
Exact Mass187.19
IUPAC Name2,3-dimethyl-N-(2-propan-2-yloxyethyl)butan-1-amine
SMILESCC(C)OCCNCC(C)C(C)C
InChIInChI=1S/C11H25NO/c1-9(2)11(5)8-12-6-7-13-10(3)4/h9-12H,6-8H2,1-5H3
InChIKeyQPHSPOQPEDIJGO-UHFFFAOYSA-N
XLogP2.29
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.33
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(2S)-3-(2-propan-2-yloxyethylamino)propane-1,2-diol
CID 104760155
2-methyl-3-methylsulfanyl-N-(2-propan-2-yloxyethyl)propan-1-amine
CID 63965623
3-methyl-4-(2-propan-2-yloxyethylamino)butan-1-ol
CID 66109201
4-chloro-2-methyl-N-(2-propan-2-yloxyethyl)butan-1-amine
CID 66091090
N-(2-bromoethyl)-2-propan-2-yloxyethanamine
CID 114505264
1,1,1-trifluoro-3-(2-propan-2-yloxyethylamino)propan-2-ol
CID 104760283
3-ethyl-1-(2-propan-2-yloxyethylamino)pentan-2-ol
CID 106285645
2-methyl-N-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethyl]propan-1-amine
CID 146640685
N-(2-methoxyethyl)-2-(2-propan-2-yloxyethoxy)propan-1-amine
CID 62571731
N-(3-ethoxypropyl)-2,3-dimethylbutan-1-amine
CID 65175065
2,3-dimethyl-N-(2-phenoxyethyl)butan-1-amine
CID 64571109
1-(4-methylpentan-2-yloxy)-3-(2-propan-2-yloxyethylamino)propan-2-ol
CID 104760276

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-N-(2-propan-2-yloxyethyl)butan-1-amine?
The IUPAC name of 2,3-dimethyl-N-(2-propan-2-yloxyethyl)butan-1-amine (CID 64571150) is 2,3-dimethyl-N-(2-propan-2-yloxyethyl)butan-1-amine.
What is the SMILES notation for 2,3-dimethyl-N-(2-propan-2-yloxyethyl)butan-1-amine?
The canonical SMILES for 2,3-dimethyl-N-(2-propan-2-yloxyethyl)butan-1-amine is CC(C)OCCNCC(C)C(C)C.
What is the InChIKey of 2,3-dimethyl-N-(2-propan-2-yloxyethyl)butan-1-amine?
The InChIKey is QPHSPOQPEDIJGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25NO/c1-9(2)11(5)8-12-6-7-13-10(3)4/h9-12H,6-8H2,1-5H3.
What are the key properties of 2,3-dimethyl-N-(2-propan-2-yloxyethyl)butan-1-amine?
2,3-dimethyl-N-(2-propan-2-yloxyethyl)butan-1-amine has a molecular weight of 187.33 g/mol, XLogP of 2.29, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-N-(2-propan-2-yloxyethyl)butan-1-amine is sourced from PubChem (CID 64571150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).