2-methyl-2-(2-methylpropoxy)butan-1-amine

C9H21NO — CID 62355442

IUPAC2-methyl-2-(2-methylpropoxy)butan-1-amine
SMILESCCC(C)(CN)OCC(C)C
InChIInChI=1S/C9H21NO/c1-5-9(4,7-10)11-6-8(2)3/h8H,5-7,10H2,1-4H3
InChIKeyFACYZFCESJXQIQ-UHFFFAOYSA-N
MW159.27 g/mol
LogP1.79
Rot. Bonds5

About 2-methyl-2-(2-methylpropoxy)butan-1-amine

2-methyl-2-(2-methylpropoxy)butan-1-amine (PubChem CID 62355442) has the molecular formula C9H21NO and a molecular weight of 159.27 g/mol. Its IUPAC name is 2-methyl-2-(2-methylpropoxy)butan-1-amine.

Molecular Properties

Compound Name2-methyl-2-(2-methylpropoxy)butan-1-amine
PubChem CID62355442
Molecular FormulaC9H21NO
Molecular Weight159.27 g/mol
Exact Mass159.16
IUPAC Name2-methyl-2-(2-methylpropoxy)butan-1-amine
SMILESCCC(C)(CN)OCC(C)C
InChIInChI=1S/C9H21NO/c1-5-9(4,7-10)11-6-8(2)3/h8H,5-7,10H2,1-4H3
InChIKeyFACYZFCESJXQIQ-UHFFFAOYSA-N
XLogP1.79
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.27
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-methyl-2-(2-methylpropoxy)butan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-methyl-1-(3-methylpentan-3-yloxy)-3-(2-methylpropoxy)pentane
CID 89169879
N-ethyl-2-methyl-2-(2-methylpropoxy)butan-1-amine
CID 62355640
3-ethyl-3-(2-methylpropoxy)pentane
CID 123413367
2-(difluoromethoxy)-2-methylbutan-1-amine
CID 65053075
2-(1-amino-2-methylbutan-2-yl)oxy-N,N-dimethylacetamide
CID 65053796
3-methyl-3-(3-methylpentan-3-ylperoxy)pentane
CID 19875132
2-methyl-2-(2-methylpropoxy)propanamide
CID 137483152
2-(1-amino-2-methylbutan-2-yl)oxy-N,N-diethylacetamide
CID 65053795
2-(3-methylpentan-3-yloxy)ethanamine
CID 87222058
2-methyl-2-(2-methylpropoxy)-1-(2-propoxyethoxy)propane
CID 155206802
2-[(4-fluorophenyl)methoxy]-2-methylbutan-1-amine
CID 65053286
4,4-bis(2-methylpropoxy)heptane
CID 89439666

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-(2-methylpropoxy)butan-1-amine?
The IUPAC name of 2-methyl-2-(2-methylpropoxy)butan-1-amine (CID 62355442) is 2-methyl-2-(2-methylpropoxy)butan-1-amine.
What is the SMILES notation for 2-methyl-2-(2-methylpropoxy)butan-1-amine?
The canonical SMILES for 2-methyl-2-(2-methylpropoxy)butan-1-amine is CCC(C)(CN)OCC(C)C.
What is the InChIKey of 2-methyl-2-(2-methylpropoxy)butan-1-amine?
The InChIKey is FACYZFCESJXQIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21NO/c1-5-9(4,7-10)11-6-8(2)3/h8H,5-7,10H2,1-4H3.
What are the key properties of 2-methyl-2-(2-methylpropoxy)butan-1-amine?
2-methyl-2-(2-methylpropoxy)butan-1-amine has a molecular weight of 159.27 g/mol, XLogP of 1.79, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-(2-methylpropoxy)butan-1-amine is sourced from PubChem (CID 62355442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).