5-methylpiperidin-3-amine

C6H14N2 — CID 42628666

IUPAC5-methylpiperidin-3-amine
SMILESCC1CNCC(N)C1
InChIInChI=1S/C6H14N2/c1-5-2-6(7)4-8-3-5/h5-6,8H,2-4,7H2,1H3
InChIKeyPQOHPULQDOKUOG-UHFFFAOYSA-N
MW114.19 g/mol
LogP-0.06
Rot. Bonds

About 5-methylpiperidin-3-amine

5-methylpiperidin-3-amine (PubChem CID 42628666) has the molecular formula C6H14N2 and a molecular weight of 114.19 g/mol. Its IUPAC name is 5-methylpiperidin-3-amine.

Molecular Properties

Compound Name5-methylpiperidin-3-amine
PubChem CID42628666
Molecular FormulaC6H14N2
Molecular Weight114.19 g/mol
Exact Mass114.12
IUPAC Name5-methylpiperidin-3-amine
SMILESCC1CNCC(N)C1
InChIInChI=1S/C6H14N2/c1-5-2-6(7)4-8-3-5/h5-6,8H,2-4,7H2,1H3
InChIKeyPQOHPULQDOKUOG-UHFFFAOYSA-N
XLogP-0.06
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.19
LogP ≤ 5-0.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-methylpiperidin-3-amine?
The IUPAC name of 5-methylpiperidin-3-amine (CID 42628666) is 5-methylpiperidin-3-amine.
What is the SMILES notation for 5-methylpiperidin-3-amine?
The canonical SMILES for 5-methylpiperidin-3-amine is CC1CNCC(N)C1.
What is the InChIKey of 5-methylpiperidin-3-amine?
The InChIKey is PQOHPULQDOKUOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2/c1-5-2-6(7)4-8-3-5/h5-6,8H,2-4,7H2,1H3.
What are the key properties of 5-methylpiperidin-3-amine?
5-methylpiperidin-3-amine has a molecular weight of 114.19 g/mol, XLogP of -0.06, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methylpiperidin-3-amine is sourced from PubChem (CID 42628666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).