N-ethyl-2,2-dimethyl-6-propan-2-ylpiperidin-4-amine

C12H26N2 — CID 121244500

IUPACN-ethyl-2,2-dimethyl-6-propan-2-ylpiperidin-4-amine
SMILESCCNC1CC(C(C)C)NC(C)(C)C1
InChIInChI=1S/C12H26N2/c1-6-13-10-7-11(9(2)3)14-12(4,5)8-10/h9-11,13-14H,6-8H2,1-5H3
InChIKeyYSJJZSWSISUNTN-UHFFFAOYSA-N
MW198.35 g/mol
LogP2.15
Rot. Bonds3

About N-ethyl-2,2-dimethyl-6-propan-2-ylpiperidin-4-amine

N-ethyl-2,2-dimethyl-6-propan-2-ylpiperidin-4-amine (PubChem CID 121244500) has the molecular formula C12H26N2 and a molecular weight of 198.35 g/mol. Its IUPAC name is N-ethyl-2,2-dimethyl-6-propan-2-ylpiperidin-4-amine.

Molecular Properties

Compound NameN-ethyl-2,2-dimethyl-6-propan-2-ylpiperidin-4-amine
PubChem CID121244500
Molecular FormulaC12H26N2
Molecular Weight198.35 g/mol
Exact Mass198.21
IUPAC NameN-ethyl-2,2-dimethyl-6-propan-2-ylpiperidin-4-amine
SMILESCCNC1CC(C(C)C)NC(C)(C)C1
InChIInChI=1S/C12H26N2/c1-6-13-10-7-11(9(2)3)14-12(4,5)8-10/h9-11,13-14H,6-8H2,1-5H3
InChIKeyYSJJZSWSISUNTN-UHFFFAOYSA-N
XLogP2.15
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.35
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2,2-dimethyl-6-propan-2-ylpiperidin-4-amine?
The IUPAC name of N-ethyl-2,2-dimethyl-6-propan-2-ylpiperidin-4-amine (CID 121244500) is N-ethyl-2,2-dimethyl-6-propan-2-ylpiperidin-4-amine.
What is the SMILES notation for N-ethyl-2,2-dimethyl-6-propan-2-ylpiperidin-4-amine?
The canonical SMILES for N-ethyl-2,2-dimethyl-6-propan-2-ylpiperidin-4-amine is CCNC1CC(C(C)C)NC(C)(C)C1.
What is the InChIKey of N-ethyl-2,2-dimethyl-6-propan-2-ylpiperidin-4-amine?
The InChIKey is YSJJZSWSISUNTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2/c1-6-13-10-7-11(9(2)3)14-12(4,5)8-10/h9-11,13-14H,6-8H2,1-5H3.
What are the key properties of N-ethyl-2,2-dimethyl-6-propan-2-ylpiperidin-4-amine?
N-ethyl-2,2-dimethyl-6-propan-2-ylpiperidin-4-amine has a molecular weight of 198.35 g/mol, XLogP of 2.15, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2,2-dimethyl-6-propan-2-ylpiperidin-4-amine is sourced from PubChem (CID 121244500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).