2,3-dimethyl-5-(3-methylbutan-2-yl)piperidine

C12H25N — CID 130631378

IUPAC2,3-dimethyl-5-(3-methylbutan-2-yl)piperidine
SMILESCC(C)C(C)C1CNC(C)C(C)C1
InChIInChI=1S/C12H25N/c1-8(2)10(4)12-6-9(3)11(5)13-7-12/h8-13H,6-7H2,1-5H3
InChIKeyASFAQRATJNBXPN-UHFFFAOYSA-N
MW183.34 g/mol
LogP2.91
Rot. Bonds2

About 2,3-dimethyl-5-(3-methylbutan-2-yl)piperidine

2,3-dimethyl-5-(3-methylbutan-2-yl)piperidine (PubChem CID 130631378) has the molecular formula C12H25N and a molecular weight of 183.34 g/mol. Its IUPAC name is 2,3-dimethyl-5-(3-methylbutan-2-yl)piperidine.

Molecular Properties

Compound Name2,3-dimethyl-5-(3-methylbutan-2-yl)piperidine
PubChem CID130631378
Molecular FormulaC12H25N
Molecular Weight183.34 g/mol
Exact Mass183.20
IUPAC Name2,3-dimethyl-5-(3-methylbutan-2-yl)piperidine
SMILESCC(C)C(C)C1CNC(C)C(C)C1
InChIInChI=1S/C12H25N/c1-8(2)10(4)12-6-9(3)11(5)13-7-12/h8-13H,6-7H2,1-5H3
InChIKeyASFAQRATJNBXPN-UHFFFAOYSA-N
XLogP2.91
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.34
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2,3-dimethyl-5-(3-methylbutan-2-yl)piperidine 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 2,3-dimethyl-5-(3-methylbutan-2-yl)piperidine?
The IUPAC name of 2,3-dimethyl-5-(3-methylbutan-2-yl)piperidine (CID 130631378) is 2,3-dimethyl-5-(3-methylbutan-2-yl)piperidine.
What is the SMILES notation for 2,3-dimethyl-5-(3-methylbutan-2-yl)piperidine?
The canonical SMILES for 2,3-dimethyl-5-(3-methylbutan-2-yl)piperidine is CC(C)C(C)C1CNC(C)C(C)C1.
What is the InChIKey of 2,3-dimethyl-5-(3-methylbutan-2-yl)piperidine?
The InChIKey is ASFAQRATJNBXPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N/c1-8(2)10(4)12-6-9(3)11(5)13-7-12/h8-13H,6-7H2,1-5H3.
What are the key properties of 2,3-dimethyl-5-(3-methylbutan-2-yl)piperidine?
2,3-dimethyl-5-(3-methylbutan-2-yl)piperidine has a molecular weight of 183.34 g/mol, XLogP of 2.91, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-5-(3-methylbutan-2-yl)piperidine is sourced from PubChem (CID 130631378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).