2,2-dimethyl-N-propyl-3-(1,3,5-trimethylpyrazol-4-yl)oxycyclobutan-1-amine

C15H27N3O — CID 66352052

IUPAC2,2-dimethyl-N-propyl-3-(1,3,5-trimethylpyrazol-4-yl)oxycyclobutan-1-amine
SMILESCCCNC1CC(Oc2c(C)nn(C)c2C)C1(C)C
InChIInChI=1S/C15H27N3O/c1-7-8-16-12-9-13(15(12,4)5)19-14-10(2)17-18(6)11(14)3/h12-13,16H,7-9H2,1-6H3
InChIKeyDFNVADOIKYCKFF-UHFFFAOYSA-N
MW265.40 g/mol
LogP2.58
Rot. Bonds5

About 2,2-dimethyl-N-propyl-3-(1,3,5-trimethylpyrazol-4-yl)oxycyclobutan-1-amine

2,2-dimethyl-N-propyl-3-(1,3,5-trimethylpyrazol-4-yl)oxycyclobutan-1-amine (PubChem CID 66352052) has the molecular formula C15H27N3O and a molecular weight of 265.40 g/mol. Its IUPAC name is 2,2-dimethyl-N-propyl-3-(1,3,5-trimethylpyrazol-4-yl)oxycyclobutan-1-amine.

Molecular Properties

Compound Name2,2-dimethyl-N-propyl-3-(1,3,5-trimethylpyrazol-4-yl)oxycyclobutan-1-amine
PubChem CID66352052
Molecular FormulaC15H27N3O
Molecular Weight265.40 g/mol
Exact Mass265.22
IUPAC Name2,2-dimethyl-N-propyl-3-(1,3,5-trimethylpyrazol-4-yl)oxycyclobutan-1-amine
SMILESCCCNC1CC(Oc2c(C)nn(C)c2C)C1(C)C
InChIInChI=1S/C15H27N3O/c1-7-8-16-12-9-13(15(12,4)5)19-14-10(2)17-18(6)11(14)3/h12-13,16H,7-9H2,1-6H3
InChIKeyDFNVADOIKYCKFF-UHFFFAOYSA-N
XLogP2.58
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2,2-dimethyl-N-propyl-3-(1,3,5-trimethylpyrazol-4-yl)oxycyclobutan-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-dimethyl-N-propyl-3-(1,3,5-trimethylpyrazol-4-yl)oxycyclobutan-1-amine?
The IUPAC name of 2,2-dimethyl-N-propyl-3-(1,3,5-trimethylpyrazol-4-yl)oxycyclobutan-1-amine (CID 66352052) is 2,2-dimethyl-N-propyl-3-(1,3,5-trimethylpyrazol-4-yl)oxycyclobutan-1-amine.
What is the SMILES notation for 2,2-dimethyl-N-propyl-3-(1,3,5-trimethylpyrazol-4-yl)oxycyclobutan-1-amine?
The canonical SMILES for 2,2-dimethyl-N-propyl-3-(1,3,5-trimethylpyrazol-4-yl)oxycyclobutan-1-amine is CCCNC1CC(Oc2c(C)nn(C)c2C)C1(C)C.
What is the InChIKey of 2,2-dimethyl-N-propyl-3-(1,3,5-trimethylpyrazol-4-yl)oxycyclobutan-1-amine?
The InChIKey is DFNVADOIKYCKFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O/c1-7-8-16-12-9-13(15(12,4)5)19-14-10(2)17-18(6)11(14)3/h12-13,16H,7-9H2,1-6H3.
What are the key properties of 2,2-dimethyl-N-propyl-3-(1,3,5-trimethylpyrazol-4-yl)oxycyclobutan-1-amine?
2,2-dimethyl-N-propyl-3-(1,3,5-trimethylpyrazol-4-yl)oxycyclobutan-1-amine has a molecular weight of 265.40 g/mol, XLogP of 2.58, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-propyl-3-(1,3,5-trimethylpyrazol-4-yl)oxycyclobutan-1-amine is sourced from PubChem (CID 66352052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).