N-[2-[2-(aminomethyl)-4-methylpiperazin-1-yl]ethyl]acetamide

C10H22N4O — CID 80507319

IUPACN-[2-[2-(aminomethyl)-4-methylpiperazin-1-yl]ethyl]acetamide
SMILESCC(=O)NCCN1CCN(C)CC1CN
InChIInChI=1S/C10H22N4O/c1-9(15)12-3-4-14-6-5-13(2)8-10(14)7-11/h10H,3-8,11H2,1-2H3,(H,12,15)
InChIKeyPJETYZUJLSQKKG-UHFFFAOYSA-N
MW214.31 g/mol
LogP-1.30
Rot. Bonds4

About N-[2-[2-(aminomethyl)-4-methylpiperazin-1-yl]ethyl]acetamide

N-[2-[2-(aminomethyl)-4-methylpiperazin-1-yl]ethyl]acetamide (PubChem CID 80507319) has the molecular formula C10H22N4O and a molecular weight of 214.31 g/mol. Its IUPAC name is N-[2-[2-(aminomethyl)-4-methylpiperazin-1-yl]ethyl]acetamide.

Molecular Properties

Compound NameN-[2-[2-(aminomethyl)-4-methylpiperazin-1-yl]ethyl]acetamide
PubChem CID80507319
Molecular FormulaC10H22N4O
Molecular Weight214.31 g/mol
Exact Mass214.18
IUPAC NameN-[2-[2-(aminomethyl)-4-methylpiperazin-1-yl]ethyl]acetamide
SMILESCC(=O)NCCN1CCN(C)CC1CN
InChIInChI=1S/C10H22N4O/c1-9(15)12-3-4-14-6-5-13(2)8-10(14)7-11/h10H,3-8,11H2,1-2H3,(H,12,15)
InChIKeyPJETYZUJLSQKKG-UHFFFAOYSA-N
XLogP-1.30
TPSA61.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 5-1.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[2-[2-(aminomethyl)-4-methylpiperazin-1-yl]ethyl]acetamide 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-[2-(aminomethyl)-4-methylpiperazin-1-yl]ethyl]acetamide?
The IUPAC name of N-[2-[2-(aminomethyl)-4-methylpiperazin-1-yl]ethyl]acetamide (CID 80507319) is N-[2-[2-(aminomethyl)-4-methylpiperazin-1-yl]ethyl]acetamide.
What is the SMILES notation for N-[2-[2-(aminomethyl)-4-methylpiperazin-1-yl]ethyl]acetamide?
The canonical SMILES for N-[2-[2-(aminomethyl)-4-methylpiperazin-1-yl]ethyl]acetamide is CC(=O)NCCN1CCN(C)CC1CN.
What is the InChIKey of N-[2-[2-(aminomethyl)-4-methylpiperazin-1-yl]ethyl]acetamide?
The InChIKey is PJETYZUJLSQKKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N4O/c1-9(15)12-3-4-14-6-5-13(2)8-10(14)7-11/h10H,3-8,11H2,1-2H3,(H,12,15).
What are the key properties of N-[2-[2-(aminomethyl)-4-methylpiperazin-1-yl]ethyl]acetamide?
N-[2-[2-(aminomethyl)-4-methylpiperazin-1-yl]ethyl]acetamide has a molecular weight of 214.31 g/mol, XLogP of -1.30, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-(aminomethyl)-4-methylpiperazin-1-yl]ethyl]acetamide is sourced from PubChem (CID 80507319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).