N-[2-(3-amino-5-methylpiperidin-1-yl)ethyl]acetamide

C10H21N3O — CID 79993303

IUPACN-[2-(3-amino-5-methylpiperidin-1-yl)ethyl]acetamide
SMILESCC(=O)NCCN1CC(C)CC(N)C1
InChIInChI=1S/C10H21N3O/c1-8-5-10(11)7-13(6-8)4-3-12-9(2)14/h8,10H,3-7,11H2,1-2H3,(H,12,14)
InChIKeyZMTGVJLEIRFTTG-UHFFFAOYSA-N
MW199.30 g/mol
LogP-0.21
Rot. Bonds3

About N-[2-(3-amino-5-methylpiperidin-1-yl)ethyl]acetamide

N-[2-(3-amino-5-methylpiperidin-1-yl)ethyl]acetamide (PubChem CID 79993303) has the molecular formula C10H21N3O and a molecular weight of 199.30 g/mol. Its IUPAC name is N-[2-(3-amino-5-methylpiperidin-1-yl)ethyl]acetamide.

Molecular Properties

Compound NameN-[2-(3-amino-5-methylpiperidin-1-yl)ethyl]acetamide
PubChem CID79993303
Molecular FormulaC10H21N3O
Molecular Weight199.30 g/mol
Exact Mass199.17
IUPAC NameN-[2-(3-amino-5-methylpiperidin-1-yl)ethyl]acetamide
SMILESCC(=O)NCCN1CC(C)CC(N)C1
InChIInChI=1S/C10H21N3O/c1-8-5-10(11)7-13(6-8)4-3-12-9(2)14/h8,10H,3-7,11H2,1-2H3,(H,12,14)
InChIKeyZMTGVJLEIRFTTG-UHFFFAOYSA-N
XLogP-0.21
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.30
LogP ≤ 5-0.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-(3-amino-5-methylpiperidin-1-yl)ethyl]acetamide?
The IUPAC name of N-[2-(3-amino-5-methylpiperidin-1-yl)ethyl]acetamide (CID 79993303) is N-[2-(3-amino-5-methylpiperidin-1-yl)ethyl]acetamide.
What is the SMILES notation for N-[2-(3-amino-5-methylpiperidin-1-yl)ethyl]acetamide?
The canonical SMILES for N-[2-(3-amino-5-methylpiperidin-1-yl)ethyl]acetamide is CC(=O)NCCN1CC(C)CC(N)C1.
What is the InChIKey of N-[2-(3-amino-5-methylpiperidin-1-yl)ethyl]acetamide?
The InChIKey is ZMTGVJLEIRFTTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O/c1-8-5-10(11)7-13(6-8)4-3-12-9(2)14/h8,10H,3-7,11H2,1-2H3,(H,12,14).
What are the key properties of N-[2-(3-amino-5-methylpiperidin-1-yl)ethyl]acetamide?
N-[2-(3-amino-5-methylpiperidin-1-yl)ethyl]acetamide has a molecular weight of 199.30 g/mol, XLogP of -0.21, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-amino-5-methylpiperidin-1-yl)ethyl]acetamide is sourced from PubChem (CID 79993303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).