2-[methyl-[5-(methylaminomethyl)-2-pyridinyl]amino]acetamide

C10H16N4O — CID 80630822

IUPAC2-[methyl-[5-(methylaminomethyl)-2-pyridinyl]amino]acetamide
SMILESCNCc1ccc(N(C)CC(N)=O)nc1
InChIInChI=1S/C10H16N4O/c1-12-5-8-3-4-10(13-6-8)14(2)7-9(11)15/h3-4,6,12H,5,7H2,1-2H3,(H2,11,15)
InChIKeyMSMJJZRNLFMTHA-UHFFFAOYSA-N
MW208.27 g/mol
LogP-0.28
Rot. Bonds5

About 2-[methyl-[5-(methylaminomethyl)-2-pyridinyl]amino]acetamide

2-[methyl-[5-(methylaminomethyl)-2-pyridinyl]amino]acetamide (PubChem CID 80630822) has the molecular formula C10H16N4O and a molecular weight of 208.27 g/mol. Its IUPAC name is 2-[methyl-[5-(methylaminomethyl)-2-pyridinyl]amino]acetamide.

Molecular Properties

Compound Name2-[methyl-[5-(methylaminomethyl)-2-pyridinyl]amino]acetamide
PubChem CID80630822
Molecular FormulaC10H16N4O
Molecular Weight208.27 g/mol
Exact Mass208.13
IUPAC Name2-[methyl-[5-(methylaminomethyl)-2-pyridinyl]amino]acetamide
SMILESCNCc1ccc(N(C)CC(N)=O)nc1
InChIInChI=1S/C10H16N4O/c1-12-5-8-3-4-10(13-6-8)14(2)7-9(11)15/h3-4,6,12H,5,7H2,1-2H3,(H2,11,15)
InChIKeyMSMJJZRNLFMTHA-UHFFFAOYSA-N
XLogP-0.28
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.27
LogP ≤ 5-0.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[methyl-[5-(methylaminomethyl)-2-pyridinyl]amino]acetamide?
The IUPAC name of 2-[methyl-[5-(methylaminomethyl)-2-pyridinyl]amino]acetamide (CID 80630822) is 2-[methyl-[5-(methylaminomethyl)-2-pyridinyl]amino]acetamide.
What is the SMILES notation for 2-[methyl-[5-(methylaminomethyl)-2-pyridinyl]amino]acetamide?
The canonical SMILES for 2-[methyl-[5-(methylaminomethyl)-2-pyridinyl]amino]acetamide is CNCc1ccc(N(C)CC(N)=O)nc1.
What is the InChIKey of 2-[methyl-[5-(methylaminomethyl)-2-pyridinyl]amino]acetamide?
The InChIKey is MSMJJZRNLFMTHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-12-5-8-3-4-10(13-6-8)14(2)7-9(11)15/h3-4,6,12H,5,7H2,1-2H3,(H2,11,15).
What are the key properties of 2-[methyl-[5-(methylaminomethyl)-2-pyridinyl]amino]acetamide?
2-[methyl-[5-(methylaminomethyl)-2-pyridinyl]amino]acetamide has a molecular weight of 208.27 g/mol, XLogP of -0.28, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl-[5-(methylaminomethyl)-2-pyridinyl]amino]acetamide is sourced from PubChem (CID 80630822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).