4-[2-(aminomethyl)morpholin-4-yl]-2,6-dimethylpyridine-3-carboxamide

C13H20N4O2 — CID 114399300

IUPAC4-[2-(aminomethyl)morpholin-4-yl]-2,6-dimethylpyridine-3-carboxamide
SMILESCc1cc(N2CCOC(CN)C2)c(C(N)=O)c(C)n1
InChIInChI=1S/C13H20N4O2/c1-8-5-11(12(13(15)18)9(2)16-8)17-3-4-19-10(6-14)7-17/h5,10H,3-4,6-7,14H2,1-2H3,(H2,15,18)
InChIKeyZEANRESSHVAMSS-UHFFFAOYSA-N
MW264.33 g/mol
LogP-0.04
Rot. Bonds3

About 4-[2-(aminomethyl)morpholin-4-yl]-2,6-dimethylpyridine-3-carboxamide

4-[2-(aminomethyl)morpholin-4-yl]-2,6-dimethylpyridine-3-carboxamide (PubChem CID 114399300) has the molecular formula C13H20N4O2 and a molecular weight of 264.33 g/mol. Its IUPAC name is 4-[2-(aminomethyl)morpholin-4-yl]-2,6-dimethylpyridine-3-carboxamide.

Molecular Properties

Compound Name4-[2-(aminomethyl)morpholin-4-yl]-2,6-dimethylpyridine-3-carboxamide
PubChem CID114399300
Molecular FormulaC13H20N4O2
Molecular Weight264.33 g/mol
Exact Mass264.16
IUPAC Name4-[2-(aminomethyl)morpholin-4-yl]-2,6-dimethylpyridine-3-carboxamide
SMILESCc1cc(N2CCOC(CN)C2)c(C(N)=O)c(C)n1
InChIInChI=1S/C13H20N4O2/c1-8-5-11(12(13(15)18)9(2)16-8)17-3-4-19-10(6-14)7-17/h5,10H,3-4,6-7,14H2,1-2H3,(H2,15,18)
InChIKeyZEANRESSHVAMSS-UHFFFAOYSA-N
XLogP-0.04
TPSA94.47 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 5-0.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 4-[2-(aminomethyl)morpholin-4-yl]-2,6-dimethylpyridine-3-carboxamide 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-[2-(aminomethyl)morpholin-4-yl]-2,6-dimethylpyridine-3-carboxamide?
The IUPAC name of 4-[2-(aminomethyl)morpholin-4-yl]-2,6-dimethylpyridine-3-carboxamide (CID 114399300) is 4-[2-(aminomethyl)morpholin-4-yl]-2,6-dimethylpyridine-3-carboxamide.
What is the SMILES notation for 4-[2-(aminomethyl)morpholin-4-yl]-2,6-dimethylpyridine-3-carboxamide?
The canonical SMILES for 4-[2-(aminomethyl)morpholin-4-yl]-2,6-dimethylpyridine-3-carboxamide is Cc1cc(N2CCOC(CN)C2)c(C(N)=O)c(C)n1.
What is the InChIKey of 4-[2-(aminomethyl)morpholin-4-yl]-2,6-dimethylpyridine-3-carboxamide?
The InChIKey is ZEANRESSHVAMSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O2/c1-8-5-11(12(13(15)18)9(2)16-8)17-3-4-19-10(6-14)7-17/h5,10H,3-4,6-7,14H2,1-2H3,(H2,15,18).
What are the key properties of 4-[2-(aminomethyl)morpholin-4-yl]-2,6-dimethylpyridine-3-carboxamide?
4-[2-(aminomethyl)morpholin-4-yl]-2,6-dimethylpyridine-3-carboxamide has a molecular weight of 264.33 g/mol, XLogP of -0.04, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(aminomethyl)morpholin-4-yl]-2,6-dimethylpyridine-3-carboxamide is sourced from PubChem (CID 114399300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).