N,N-dimethyl-1-(3-methylpentan-3-yl)piperidin-4-amine

C13H28N2 — CID 134214368

IUPACN,N-dimethyl-1-(3-methylpentan-3-yl)piperidin-4-amine
SMILESCCC(C)(CC)N1CCC(N(C)C)CC1
InChIInChI=1S/C13H28N2/c1-6-13(3,7-2)15-10-8-12(9-11-15)14(4)5/h12H,6-11H2,1-5H3
InChIKeyXRGCNZCTLOCDRZ-UHFFFAOYSA-N
MW212.38 g/mol
LogP2.59
Rot. Bonds4

About N,N-dimethyl-1-(3-methylpentan-3-yl)piperidin-4-amine

N,N-dimethyl-1-(3-methylpentan-3-yl)piperidin-4-amine (PubChem CID 134214368) has the molecular formula C13H28N2 and a molecular weight of 212.38 g/mol. Its IUPAC name is N,N-dimethyl-1-(3-methylpentan-3-yl)piperidin-4-amine.

Molecular Properties

Compound NameN,N-dimethyl-1-(3-methylpentan-3-yl)piperidin-4-amine
PubChem CID134214368
Molecular FormulaC13H28N2
Molecular Weight212.38 g/mol
Exact Mass212.23
IUPAC NameN,N-dimethyl-1-(3-methylpentan-3-yl)piperidin-4-amine
SMILESCCC(C)(CC)N1CCC(N(C)C)CC1
InChIInChI=1S/C13H28N2/c1-6-13(3,7-2)15-10-8-12(9-11-15)14(4)5/h12H,6-11H2,1-5H3
InChIKeyXRGCNZCTLOCDRZ-UHFFFAOYSA-N
XLogP2.59
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.38
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-(3-methylpentan-3-yl)piperidin-4-amine?
The IUPAC name of N,N-dimethyl-1-(3-methylpentan-3-yl)piperidin-4-amine (CID 134214368) is N,N-dimethyl-1-(3-methylpentan-3-yl)piperidin-4-amine.
What is the SMILES notation for N,N-dimethyl-1-(3-methylpentan-3-yl)piperidin-4-amine?
The canonical SMILES for N,N-dimethyl-1-(3-methylpentan-3-yl)piperidin-4-amine is CCC(C)(CC)N1CCC(N(C)C)CC1.
What is the InChIKey of N,N-dimethyl-1-(3-methylpentan-3-yl)piperidin-4-amine?
The InChIKey is XRGCNZCTLOCDRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2/c1-6-13(3,7-2)15-10-8-12(9-11-15)14(4)5/h12H,6-11H2,1-5H3.
What are the key properties of N,N-dimethyl-1-(3-methylpentan-3-yl)piperidin-4-amine?
N,N-dimethyl-1-(3-methylpentan-3-yl)piperidin-4-amine has a molecular weight of 212.38 g/mol, XLogP of 2.59, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-(3-methylpentan-3-yl)piperidin-4-amine is sourced from PubChem (CID 134214368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).