2,2,3,3-tetramethyl-5-(2-methyl-4-propan-2-yloxybutan-2-yl)oxypentan-1-amine

C17H37NO2 — CID 134378667

IUPAC2,2,3,3-tetramethyl-5-(2-methyl-4-propan-2-yloxybutan-2-yl)oxypentan-1-amine
SMILESCC(C)OCCC(C)(C)OCCC(C)(C)C(C)(C)CN
InChIInChI=1S/C17H37NO2/c1-14(2)19-11-10-17(7,8)20-12-9-15(3,4)16(5,6)13-18/h14H,9-13,18H2,1-8H3
InChIKeyVLNIIUJYCFZKBA-UHFFFAOYSA-N
MW287.49 g/mol
LogP4.00
Rot. Bonds10

About 2,2,3,3-tetramethyl-5-(2-methyl-4-propan-2-yloxybutan-2-yl)oxypentan-1-amine

2,2,3,3-tetramethyl-5-(2-methyl-4-propan-2-yloxybutan-2-yl)oxypentan-1-amine (PubChem CID 134378667) has the molecular formula C17H37NO2 and a molecular weight of 287.49 g/mol. Its IUPAC name is 2,2,3,3-tetramethyl-5-(2-methyl-4-propan-2-yloxybutan-2-yl)oxypentan-1-amine.

Molecular Properties

Compound Name2,2,3,3-tetramethyl-5-(2-methyl-4-propan-2-yloxybutan-2-yl)oxypentan-1-amine
PubChem CID134378667
Molecular FormulaC17H37NO2
Molecular Weight287.49 g/mol
Exact Mass287.28
IUPAC Name2,2,3,3-tetramethyl-5-(2-methyl-4-propan-2-yloxybutan-2-yl)oxypentan-1-amine
SMILESCC(C)OCCC(C)(C)OCCC(C)(C)C(C)(C)CN
InChIInChI=1S/C17H37NO2/c1-14(2)19-11-10-17(7,8)20-12-9-15(3,4)16(5,6)13-18/h14H,9-13,18H2,1-8H3
InChIKeyVLNIIUJYCFZKBA-UHFFFAOYSA-N
XLogP4.00
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.49
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2,2,3,3-tetramethyl-5-(2-methyl-4-propan-2-yloxybutan-2-yl)oxypentan-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

Frequently Asked Questions

What is the IUPAC name of 2,2,3,3-tetramethyl-5-(2-methyl-4-propan-2-yloxybutan-2-yl)oxypentan-1-amine?
The IUPAC name of 2,2,3,3-tetramethyl-5-(2-methyl-4-propan-2-yloxybutan-2-yl)oxypentan-1-amine (CID 134378667) is 2,2,3,3-tetramethyl-5-(2-methyl-4-propan-2-yloxybutan-2-yl)oxypentan-1-amine.
What is the SMILES notation for 2,2,3,3-tetramethyl-5-(2-methyl-4-propan-2-yloxybutan-2-yl)oxypentan-1-amine?
The canonical SMILES for 2,2,3,3-tetramethyl-5-(2-methyl-4-propan-2-yloxybutan-2-yl)oxypentan-1-amine is CC(C)OCCC(C)(C)OCCC(C)(C)C(C)(C)CN.
What is the InChIKey of 2,2,3,3-tetramethyl-5-(2-methyl-4-propan-2-yloxybutan-2-yl)oxypentan-1-amine?
The InChIKey is VLNIIUJYCFZKBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H37NO2/c1-14(2)19-11-10-17(7,8)20-12-9-15(3,4)16(5,6)13-18/h14H,9-13,18H2,1-8H3.
What are the key properties of 2,2,3,3-tetramethyl-5-(2-methyl-4-propan-2-yloxybutan-2-yl)oxypentan-1-amine?
2,2,3,3-tetramethyl-5-(2-methyl-4-propan-2-yloxybutan-2-yl)oxypentan-1-amine has a molecular weight of 287.49 g/mol, XLogP of 4.00, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,3,3-tetramethyl-5-(2-methyl-4-propan-2-yloxybutan-2-yl)oxypentan-1-amine is sourced from PubChem (CID 134378667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).