1,4-dimethylpiperidin-3-amine;ethane

C9H22N2 — CID 169133952

IUPAC1,4-dimethylpiperidin-3-amine;ethane
SMILESCC.CC1CCN(C)CC1N
InChIInChI=1S/C7H16N2.C2H6/c1-6-3-4-9(2)5-7(6)8;1-2/h6-7H,3-5,8H2,1-2H3;1-2H3
InChIKeyBXBYVTPBXDLFLD-UHFFFAOYSA-N
MW158.29 g/mol
LogP1.31
Rot. Bonds

About 1,4-dimethylpiperidin-3-amine;ethane

1,4-dimethylpiperidin-3-amine;ethane (PubChem CID 169133952) has the molecular formula C9H22N2 and a molecular weight of 158.29 g/mol. Its IUPAC name is 1,4-dimethylpiperidin-3-amine;ethane.

Molecular Properties

Compound Name1,4-dimethylpiperidin-3-amine;ethane
PubChem CID169133952
Molecular FormulaC9H22N2
Molecular Weight158.29 g/mol
Exact Mass158.18
IUPAC Name1,4-dimethylpiperidin-3-amine;ethane
SMILESCC.CC1CCN(C)CC1N
InChIInChI=1S/C7H16N2.C2H6/c1-6-3-4-9(2)5-7(6)8;1-2/h6-7H,3-5,8H2,1-2H3;1-2H3
InChIKeyBXBYVTPBXDLFLD-UHFFFAOYSA-N
XLogP1.31
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.29
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,4-dimethylpiperidin-3-amine;ethane?
The IUPAC name of 1,4-dimethylpiperidin-3-amine;ethane (CID 169133952) is 1,4-dimethylpiperidin-3-amine;ethane.
What is the SMILES notation for 1,4-dimethylpiperidin-3-amine;ethane?
The canonical SMILES for 1,4-dimethylpiperidin-3-amine;ethane is CC.CC1CCN(C)CC1N.
What is the InChIKey of 1,4-dimethylpiperidin-3-amine;ethane?
The InChIKey is BXBYVTPBXDLFLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2.C2H6/c1-6-3-4-9(2)5-7(6)8;1-2/h6-7H,3-5,8H2,1-2H3;1-2H3.
What are the key properties of 1,4-dimethylpiperidin-3-amine;ethane?
1,4-dimethylpiperidin-3-amine;ethane has a molecular weight of 158.29 g/mol, XLogP of 1.31, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-dimethylpiperidin-3-amine;ethane is sourced from PubChem (CID 169133952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).