3-[[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]amino]-N-methylpropanamide

C14H28N2O2 — CID 64851770

IUPAC3-[[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]amino]-N-methylpropanamide
SMILESCNC(=O)CCNC1CC(OCC(C)C)C1(C)C
InChIInChI=1S/C14H28N2O2/c1-10(2)9-18-12-8-11(14(12,3)4)16-7-6-13(17)15-5/h10-12,16H,6-9H2,1-5H3,(H,15,17)
InChIKeyMZJTYCXVUHZJAL-UHFFFAOYSA-N
MW256.39 g/mol
LogP1.55
Rot. Bonds7

About 3-[[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]amino]-N-methylpropanamide

3-[[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]amino]-N-methylpropanamide (PubChem CID 64851770) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is 3-[[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]amino]-N-methylpropanamide.

Molecular Properties

Compound Name3-[[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]amino]-N-methylpropanamide
PubChem CID64851770
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC Name3-[[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]amino]-N-methylpropanamide
SMILESCNC(=O)CCNC1CC(OCC(C)C)C1(C)C
InChIInChI=1S/C14H28N2O2/c1-10(2)9-18-12-8-11(14(12,3)4)16-7-6-13(17)15-5/h10-12,16H,6-9H2,1-5H3,(H,15,17)
InChIKeyMZJTYCXVUHZJAL-UHFFFAOYSA-N
XLogP1.55
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]amino]-N-methylpropanamide?
The IUPAC name of 3-[[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]amino]-N-methylpropanamide (CID 64851770) is 3-[[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]amino]-N-methylpropanamide.
What is the SMILES notation for 3-[[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]amino]-N-methylpropanamide?
The canonical SMILES for 3-[[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]amino]-N-methylpropanamide is CNC(=O)CCNC1CC(OCC(C)C)C1(C)C.
What is the InChIKey of 3-[[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]amino]-N-methylpropanamide?
The InChIKey is MZJTYCXVUHZJAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-10(2)9-18-12-8-11(14(12,3)4)16-7-6-13(17)15-5/h10-12,16H,6-9H2,1-5H3,(H,15,17).
What are the key properties of 3-[[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]amino]-N-methylpropanamide?
3-[[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]amino]-N-methylpropanamide has a molecular weight of 256.39 g/mol, XLogP of 1.55, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]amino]-N-methylpropanamide is sourced from PubChem (CID 64851770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).