4-(aminomethyl)-N-phenylpiperidin-4-amine

C12H19N3 — CID 3019514

IUPAC4-(aminomethyl)-N-phenylpiperidin-4-amine
SMILESNCC1(Nc2ccccc2)CCNCC1
InChIInChI=1S/C12H19N3/c13-10-12(6-8-14-9-7-12)15-11-4-2-1-3-5-11/h1-5,14-15H,6-10,13H2
InChIKeyZTXCELVEIDRPHK-UHFFFAOYSA-N
MW205.31 g/mol
LogP1.18
Rot. Bonds3

About 4-(aminomethyl)-N-phenylpiperidin-4-amine

4-(aminomethyl)-N-phenylpiperidin-4-amine (PubChem CID 3019514) has the molecular formula C12H19N3 and a molecular weight of 205.31 g/mol. Its IUPAC name is 4-(aminomethyl)-N-phenylpiperidin-4-amine.

Molecular Properties

Compound Name4-(aminomethyl)-N-phenylpiperidin-4-amine
PubChem CID3019514
Molecular FormulaC12H19N3
Molecular Weight205.31 g/mol
Exact Mass205.16
IUPAC Name4-(aminomethyl)-N-phenylpiperidin-4-amine
SMILESNCC1(Nc2ccccc2)CCNCC1
InChIInChI=1S/C12H19N3/c13-10-12(6-8-14-9-7-12)15-11-4-2-1-3-5-11/h1-5,14-15H,6-10,13H2
InChIKeyZTXCELVEIDRPHK-UHFFFAOYSA-N
XLogP1.18
TPSA50.08 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.31
LogP ≤ 51.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 4-(aminomethyl)-N-phenylpiperidin-4-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 4-(aminomethyl)-N-phenylpiperidin-4-amine?
The IUPAC name of 4-(aminomethyl)-N-phenylpiperidin-4-amine (CID 3019514) is 4-(aminomethyl)-N-phenylpiperidin-4-amine.
What is the SMILES notation for 4-(aminomethyl)-N-phenylpiperidin-4-amine?
The canonical SMILES for 4-(aminomethyl)-N-phenylpiperidin-4-amine is NCC1(Nc2ccccc2)CCNCC1.
What is the InChIKey of 4-(aminomethyl)-N-phenylpiperidin-4-amine?
The InChIKey is ZTXCELVEIDRPHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3/c13-10-12(6-8-14-9-7-12)15-11-4-2-1-3-5-11/h1-5,14-15H,6-10,13H2.
What are the key properties of 4-(aminomethyl)-N-phenylpiperidin-4-amine?
4-(aminomethyl)-N-phenylpiperidin-4-amine has a molecular weight of 205.31 g/mol, XLogP of 1.18, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-N-phenylpiperidin-4-amine is sourced from PubChem (CID 3019514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).