N-methyl-2-(2-methyl-1-propan-2-ylpiperidin-2-yl)ethanamine

C12H26N2 — CID 167202076

IUPACN-methyl-2-(2-methyl-1-propan-2-ylpiperidin-2-yl)ethanamine
SMILESCNCCC1(C)CCCCN1C(C)C
InChIInChI=1S/C12H26N2/c1-11(2)14-10-6-5-7-12(14,3)8-9-13-4/h11,13H,5-10H2,1-4H3
InChIKeyMKKLCRYEYWFUNL-UHFFFAOYSA-N
MW198.35 g/mol
LogP2.25
Rot. Bonds4

About N-methyl-2-(2-methyl-1-propan-2-ylpiperidin-2-yl)ethanamine

N-methyl-2-(2-methyl-1-propan-2-ylpiperidin-2-yl)ethanamine (PubChem CID 167202076) has the molecular formula C12H26N2 and a molecular weight of 198.35 g/mol. Its IUPAC name is N-methyl-2-(2-methyl-1-propan-2-ylpiperidin-2-yl)ethanamine.

Molecular Properties

Compound NameN-methyl-2-(2-methyl-1-propan-2-ylpiperidin-2-yl)ethanamine
PubChem CID167202076
Molecular FormulaC12H26N2
Molecular Weight198.35 g/mol
Exact Mass198.21
IUPAC NameN-methyl-2-(2-methyl-1-propan-2-ylpiperidin-2-yl)ethanamine
SMILESCNCCC1(C)CCCCN1C(C)C
InChIInChI=1S/C12H26N2/c1-11(2)14-10-6-5-7-12(14,3)8-9-13-4/h11,13H,5-10H2,1-4H3
InChIKeyMKKLCRYEYWFUNL-UHFFFAOYSA-N
XLogP2.25
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.35
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(2-methyl-1-propan-2-ylpiperidin-2-yl)ethanamine?
The IUPAC name of N-methyl-2-(2-methyl-1-propan-2-ylpiperidin-2-yl)ethanamine (CID 167202076) is N-methyl-2-(2-methyl-1-propan-2-ylpiperidin-2-yl)ethanamine.
What is the SMILES notation for N-methyl-2-(2-methyl-1-propan-2-ylpiperidin-2-yl)ethanamine?
The canonical SMILES for N-methyl-2-(2-methyl-1-propan-2-ylpiperidin-2-yl)ethanamine is CNCCC1(C)CCCCN1C(C)C.
What is the InChIKey of N-methyl-2-(2-methyl-1-propan-2-ylpiperidin-2-yl)ethanamine?
The InChIKey is MKKLCRYEYWFUNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2/c1-11(2)14-10-6-5-7-12(14,3)8-9-13-4/h11,13H,5-10H2,1-4H3.
What are the key properties of N-methyl-2-(2-methyl-1-propan-2-ylpiperidin-2-yl)ethanamine?
N-methyl-2-(2-methyl-1-propan-2-ylpiperidin-2-yl)ethanamine has a molecular weight of 198.35 g/mol, XLogP of 2.25, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(2-methyl-1-propan-2-ylpiperidin-2-yl)ethanamine is sourced from PubChem (CID 167202076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).