N-[2-(4-aminopiperidin-1-yl)ethyl]-N,1-dimethylpiperidin-3-amine

C14H30N4 — CID 79327766

IUPACN-[2-(4-aminopiperidin-1-yl)ethyl]-N,1-dimethylpiperidin-3-amine
SMILESCN1CCCC(N(C)CCN2CCC(N)CC2)C1
InChIInChI=1S/C14H30N4/c1-16-7-3-4-14(12-16)17(2)10-11-18-8-5-13(15)6-9-18/h13-14H,3-12,15H2,1-2H3
InChIKeyOJKXKLDQHHYYIK-UHFFFAOYSA-N
MW254.42 g/mol
LogP0.44
Rot. Bonds4

About N-[2-(4-aminopiperidin-1-yl)ethyl]-N,1-dimethylpiperidin-3-amine

N-[2-(4-aminopiperidin-1-yl)ethyl]-N,1-dimethylpiperidin-3-amine (PubChem CID 79327766) has the molecular formula C14H30N4 and a molecular weight of 254.42 g/mol. Its IUPAC name is N-[2-(4-aminopiperidin-1-yl)ethyl]-N,1-dimethylpiperidin-3-amine.

Molecular Properties

Compound NameN-[2-(4-aminopiperidin-1-yl)ethyl]-N,1-dimethylpiperidin-3-amine
PubChem CID79327766
Molecular FormulaC14H30N4
Molecular Weight254.42 g/mol
Exact Mass254.25
IUPAC NameN-[2-(4-aminopiperidin-1-yl)ethyl]-N,1-dimethylpiperidin-3-amine
SMILESCN1CCCC(N(C)CCN2CCC(N)CC2)C1
InChIInChI=1S/C14H30N4/c1-16-7-3-4-14(12-16)17(2)10-11-18-8-5-13(15)6-9-18/h13-14H,3-12,15H2,1-2H3
InChIKeyOJKXKLDQHHYYIK-UHFFFAOYSA-N
XLogP0.44
TPSA35.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 50.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[2-(4-aminopiperidin-1-yl)ethyl]-N,1-dimethylpiperidin-3-amine 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 N-[2-(4-aminopiperidin-1-yl)ethyl]-N,1-dimethylpiperidin-3-amine?
The IUPAC name of N-[2-(4-aminopiperidin-1-yl)ethyl]-N,1-dimethylpiperidin-3-amine (CID 79327766) is N-[2-(4-aminopiperidin-1-yl)ethyl]-N,1-dimethylpiperidin-3-amine.
What is the SMILES notation for N-[2-(4-aminopiperidin-1-yl)ethyl]-N,1-dimethylpiperidin-3-amine?
The canonical SMILES for N-[2-(4-aminopiperidin-1-yl)ethyl]-N,1-dimethylpiperidin-3-amine is CN1CCCC(N(C)CCN2CCC(N)CC2)C1.
What is the InChIKey of N-[2-(4-aminopiperidin-1-yl)ethyl]-N,1-dimethylpiperidin-3-amine?
The InChIKey is OJKXKLDQHHYYIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N4/c1-16-7-3-4-14(12-16)17(2)10-11-18-8-5-13(15)6-9-18/h13-14H,3-12,15H2,1-2H3.
What are the key properties of N-[2-(4-aminopiperidin-1-yl)ethyl]-N,1-dimethylpiperidin-3-amine?
N-[2-(4-aminopiperidin-1-yl)ethyl]-N,1-dimethylpiperidin-3-amine has a molecular weight of 254.42 g/mol, XLogP of 0.44, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-aminopiperidin-1-yl)ethyl]-N,1-dimethylpiperidin-3-amine is sourced from PubChem (CID 79327766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).