1-[1-[3-(aminomethyl)-2-methyloxolan-3-yl]piperidin-4-yl]-N,N-dimethylmethanamine

C14H29N3O — CID 82719164

IUPAC1-[1-[3-(aminomethyl)-2-methyloxolan-3-yl]piperidin-4-yl]-N,N-dimethylmethanamine
SMILESCC1OCCC1(CN)N1CCC(CN(C)C)CC1
InChIInChI=1S/C14H29N3O/c1-12-14(11-15,6-9-18-12)17-7-4-13(5-8-17)10-16(2)3/h12-13H,4-11,15H2,1-3H3
InChIKeyCQOGHORZDUACGA-UHFFFAOYSA-N
MW255.41 g/mol
LogP0.77
Rot. Bonds4

About 1-[1-[3-(aminomethyl)-2-methyloxolan-3-yl]piperidin-4-yl]-N,N-dimethylmethanamine

1-[1-[3-(aminomethyl)-2-methyloxolan-3-yl]piperidin-4-yl]-N,N-dimethylmethanamine (PubChem CID 82719164) has the molecular formula C14H29N3O and a molecular weight of 255.41 g/mol. Its IUPAC name is 1-[1-[3-(aminomethyl)-2-methyloxolan-3-yl]piperidin-4-yl]-N,N-dimethylmethanamine.

Molecular Properties

Compound Name1-[1-[3-(aminomethyl)-2-methyloxolan-3-yl]piperidin-4-yl]-N,N-dimethylmethanamine
PubChem CID82719164
Molecular FormulaC14H29N3O
Molecular Weight255.41 g/mol
Exact Mass255.23
IUPAC Name1-[1-[3-(aminomethyl)-2-methyloxolan-3-yl]piperidin-4-yl]-N,N-dimethylmethanamine
SMILESCC1OCCC1(CN)N1CCC(CN(C)C)CC1
InChIInChI=1S/C14H29N3O/c1-12-14(11-15,6-9-18-12)17-7-4-13(5-8-17)10-16(2)3/h12-13H,4-11,15H2,1-3H3
InChIKeyCQOGHORZDUACGA-UHFFFAOYSA-N
XLogP0.77
TPSA41.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.41
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-[1-[3-(aminomethyl)-2-methyloxolan-3-yl]piperidin-4-yl]-N,N-dimethylmethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[1-[3-(aminomethyl)-2-methyloxolan-3-yl]piperidin-4-yl]-N,N-dimethylmethanamine?
The IUPAC name of 1-[1-[3-(aminomethyl)-2-methyloxolan-3-yl]piperidin-4-yl]-N,N-dimethylmethanamine (CID 82719164) is 1-[1-[3-(aminomethyl)-2-methyloxolan-3-yl]piperidin-4-yl]-N,N-dimethylmethanamine.
What is the SMILES notation for 1-[1-[3-(aminomethyl)-2-methyloxolan-3-yl]piperidin-4-yl]-N,N-dimethylmethanamine?
The canonical SMILES for 1-[1-[3-(aminomethyl)-2-methyloxolan-3-yl]piperidin-4-yl]-N,N-dimethylmethanamine is CC1OCCC1(CN)N1CCC(CN(C)C)CC1.
What is the InChIKey of 1-[1-[3-(aminomethyl)-2-methyloxolan-3-yl]piperidin-4-yl]-N,N-dimethylmethanamine?
The InChIKey is CQOGHORZDUACGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O/c1-12-14(11-15,6-9-18-12)17-7-4-13(5-8-17)10-16(2)3/h12-13H,4-11,15H2,1-3H3.
What are the key properties of 1-[1-[3-(aminomethyl)-2-methyloxolan-3-yl]piperidin-4-yl]-N,N-dimethylmethanamine?
1-[1-[3-(aminomethyl)-2-methyloxolan-3-yl]piperidin-4-yl]-N,N-dimethylmethanamine has a molecular weight of 255.41 g/mol, XLogP of 0.77, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[3-(aminomethyl)-2-methyloxolan-3-yl]piperidin-4-yl]-N,N-dimethylmethanamine is sourced from PubChem (CID 82719164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).