3-methylidenepiperidine;N-methylmethanamine

C8H18N2 — CID 67855067

IUPAC3-methylidenepiperidine;N-methylmethanamine
SMILESC=C1CCCNC1.CNC
InChIInChI=1S/C6H11N.C2H7N/c1-6-3-2-4-7-5-6;1-3-2/h7H,1-5H2;3H,1-2H3
InChIKeyYPXCVKBJDCMUFF-UHFFFAOYSA-N
MW142.25 g/mol
LogP0.76
Rot. Bonds

About 3-methylidenepiperidine;N-methylmethanamine

3-methylidenepiperidine;N-methylmethanamine (PubChem CID 67855067) has the molecular formula C8H18N2 and a molecular weight of 142.25 g/mol. Its IUPAC name is 3-methylidenepiperidine;N-methylmethanamine.

Molecular Properties

Compound Name3-methylidenepiperidine;N-methylmethanamine
PubChem CID67855067
Molecular FormulaC8H18N2
Molecular Weight142.25 g/mol
Exact Mass142.15
IUPAC Name3-methylidenepiperidine;N-methylmethanamine
SMILESC=C1CCCNC1.CNC
InChIInChI=1S/C6H11N.C2H7N/c1-6-3-2-4-7-5-6;1-3-2/h7H,1-5H2;3H,1-2H3
InChIKeyYPXCVKBJDCMUFF-UHFFFAOYSA-N
XLogP0.76
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.25
LogP ≤ 50.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-methylidenepiperidine;N-methylmethanamine?
The IUPAC name of 3-methylidenepiperidine;N-methylmethanamine (CID 67855067) is 3-methylidenepiperidine;N-methylmethanamine.
What is the SMILES notation for 3-methylidenepiperidine;N-methylmethanamine?
The canonical SMILES for 3-methylidenepiperidine;N-methylmethanamine is C=C1CCCNC1.CNC.
What is the InChIKey of 3-methylidenepiperidine;N-methylmethanamine?
The InChIKey is YPXCVKBJDCMUFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N.C2H7N/c1-6-3-2-4-7-5-6;1-3-2/h7H,1-5H2;3H,1-2H3.
What are the key properties of 3-methylidenepiperidine;N-methylmethanamine?
3-methylidenepiperidine;N-methylmethanamine has a molecular weight of 142.25 g/mol, XLogP of 0.76, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methylidenepiperidine;N-methylmethanamine is sourced from PubChem (CID 67855067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).