(2R)-1-[2-[2-[(2R)-2-amino-3-methylbutoxy]ethoxy]ethoxy]-3-methylbutan-2-amine

C14H32N2O3 — CID 101253534

IUPAC(2R)-1-[2-[2-[(2R)-2-amino-3-methylbutoxy]ethoxy]ethoxy]-3-methylbutan-2-amine
SMILESCC(C)[C@@H](N)COCCOCCOC[C@H](N)C(C)C
InChIInChI=1S/C14H32N2O3/c1-11(2)13(15)9-18-7-5-17-6-8-19-10-14(16)12(3)4/h11-14H,5-10,15-16H2,1-4H3/t13-,14-/m0/s1
InChIKeyGBUZGQKHEIVDGT-KBPBESRZSA-N
MW276.42 g/mol
LogP1.00
Rot. Bonds12

About (2R)-1-[2-[2-[(2R)-2-amino-3-methylbutoxy]ethoxy]ethoxy]-3-methylbutan-2-amine

(2R)-1-[2-[2-[(2R)-2-amino-3-methylbutoxy]ethoxy]ethoxy]-3-methylbutan-2-amine (PubChem CID 101253534) has the molecular formula C14H32N2O3 and a molecular weight of 276.42 g/mol. Its IUPAC name is (2R)-1-[2-[2-[(2R)-2-amino-3-methylbutoxy]ethoxy]ethoxy]-3-methylbutan-2-amine.

Molecular Properties

Compound Name(2R)-1-[2-[2-[(2R)-2-amino-3-methylbutoxy]ethoxy]ethoxy]-3-methylbutan-2-amine
PubChem CID101253534
Molecular FormulaC14H32N2O3
Molecular Weight276.42 g/mol
Exact Mass276.24
IUPAC Name(2R)-1-[2-[2-[(2R)-2-amino-3-methylbutoxy]ethoxy]ethoxy]-3-methylbutan-2-amine
SMILESCC(C)[C@@H](N)COCCOCCOC[C@H](N)C(C)C
InChIInChI=1S/C14H32N2O3/c1-11(2)13(15)9-18-7-5-17-6-8-19-10-14(16)12(3)4/h11-14H,5-10,15-16H2,1-4H3/t13-,14-/m0/s1
InChIKeyGBUZGQKHEIVDGT-KBPBESRZSA-N
XLogP1.00
TPSA79.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds12
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.42
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze (2R)-1-[2-[2-[(2R)-2-amino-3-methylbutoxy]ethoxy]ethoxy]-3-methylbutan-2-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

ethyl 3-[(2R)-2-amino-3-methylbutoxy]propanoate
CID 87354947
(2R,3R)-3-amino-4-[2-(2-chloroethoxy)ethoxy]butan-2-ol
CID 15339203
2-methyl-6-(2-methylpropoxy)hexan-3-amine
CID 106454407
(2S)-1-[2-(2-methoxyethoxy)ethoxy]propan-2-amine
CID 104560725
3-methyl-1-propoxypentan-2-amine
CID 79446501
(2S)-1-[2-(2-methylpropoxy)ethoxy]propan-2-amine
CID 106447202
(2R)-1-[2-[2-(2-butoxyethoxy)ethoxy]ethoxy]propan-2-amine
CID 104560995
1-(2-butoxyethoxy)propan-2-amine
CID 43127528
1-[2-(2-aminoethoxy)ethoxy]-3-methylbutan-2-ol
CID 144781174
1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-3,3-dimethylbutan-2-amine
CID 104560569
3-methyl-1-propoxyhexan-2-amine
CID 105008414
1-[2-(1-aminoethoxy)ethoxy]propan-2-amine
CID 153419048

Frequently Asked Questions

What is the IUPAC name of (2R)-1-[2-[2-[(2R)-2-amino-3-methylbutoxy]ethoxy]ethoxy]-3-methylbutan-2-amine?
The IUPAC name of (2R)-1-[2-[2-[(2R)-2-amino-3-methylbutoxy]ethoxy]ethoxy]-3-methylbutan-2-amine (CID 101253534) is (2R)-1-[2-[2-[(2R)-2-amino-3-methylbutoxy]ethoxy]ethoxy]-3-methylbutan-2-amine.
What is the SMILES notation for (2R)-1-[2-[2-[(2R)-2-amino-3-methylbutoxy]ethoxy]ethoxy]-3-methylbutan-2-amine?
The canonical SMILES for (2R)-1-[2-[2-[(2R)-2-amino-3-methylbutoxy]ethoxy]ethoxy]-3-methylbutan-2-amine is CC(C)[C@@H](N)COCCOCCOC[C@H](N)C(C)C.
What is the InChIKey of (2R)-1-[2-[2-[(2R)-2-amino-3-methylbutoxy]ethoxy]ethoxy]-3-methylbutan-2-amine?
The InChIKey is GBUZGQKHEIVDGT-KBPBESRZSA-N. The full InChI is InChI=1S/C14H32N2O3/c1-11(2)13(15)9-18-7-5-17-6-8-19-10-14(16)12(3)4/h11-14H,5-10,15-16H2,1-4H3/t13-,14-/m0/s1.
What are the key properties of (2R)-1-[2-[2-[(2R)-2-amino-3-methylbutoxy]ethoxy]ethoxy]-3-methylbutan-2-amine?
(2R)-1-[2-[2-[(2R)-2-amino-3-methylbutoxy]ethoxy]ethoxy]-3-methylbutan-2-amine has a molecular weight of 276.42 g/mol, XLogP of 1.00, 12 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-[2-[2-[(2R)-2-amino-3-methylbutoxy]ethoxy]ethoxy]-3-methylbutan-2-amine is sourced from PubChem (CID 101253534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).