N-methyl-1-(1-methylpiperidin-4-yl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine

C15H31N3 — CID 169319670

IUPACN-methyl-1-(1-methylpiperidin-4-yl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine
SMILESCN1CCC(CN(C)CC2CCN(C)CC2)CC1
InChIInChI=1S/C15H31N3/c1-16-8-4-14(5-9-16)12-18(3)13-15-6-10-17(2)11-7-15/h14-15H,4-13H2,1-3H3
InChIKeyGZCRBBVQMCOHMV-UHFFFAOYSA-N
MW253.43 g/mol
LogP1.60
Rot. Bonds4

About N-methyl-1-(1-methylpiperidin-4-yl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine

N-methyl-1-(1-methylpiperidin-4-yl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine (PubChem CID 169319670) has the molecular formula C15H31N3 and a molecular weight of 253.43 g/mol. Its IUPAC name is N-methyl-1-(1-methylpiperidin-4-yl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine.

Molecular Properties

Compound NameN-methyl-1-(1-methylpiperidin-4-yl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine
PubChem CID169319670
Molecular FormulaC15H31N3
Molecular Weight253.43 g/mol
Exact Mass253.25
IUPAC NameN-methyl-1-(1-methylpiperidin-4-yl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine
SMILESCN1CCC(CN(C)CC2CCN(C)CC2)CC1
InChIInChI=1S/C15H31N3/c1-16-8-4-14(5-9-16)12-18(3)13-15-6-10-17(2)11-7-15/h14-15H,4-13H2,1-3H3
InChIKeyGZCRBBVQMCOHMV-UHFFFAOYSA-N
XLogP1.60
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.43
LogP ≤ 51.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(1-methylpiperidin-4-yl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine?
The IUPAC name of N-methyl-1-(1-methylpiperidin-4-yl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine (CID 169319670) is N-methyl-1-(1-methylpiperidin-4-yl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine.
What is the SMILES notation for N-methyl-1-(1-methylpiperidin-4-yl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine?
The canonical SMILES for N-methyl-1-(1-methylpiperidin-4-yl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine is CN1CCC(CN(C)CC2CCN(C)CC2)CC1.
What is the InChIKey of N-methyl-1-(1-methylpiperidin-4-yl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine?
The InChIKey is GZCRBBVQMCOHMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3/c1-16-8-4-14(5-9-16)12-18(3)13-15-6-10-17(2)11-7-15/h14-15H,4-13H2,1-3H3.
What are the key properties of N-methyl-1-(1-methylpiperidin-4-yl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine?
N-methyl-1-(1-methylpiperidin-4-yl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine has a molecular weight of 253.43 g/mol, XLogP of 1.60, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(1-methylpiperidin-4-yl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine is sourced from PubChem (CID 169319670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).