N-methyl-N-[5-(methylamino)-2-pyridinyl]acetamide

C9H13N3O — CID 59594510

IUPACN-methyl-N-[5-(methylamino)-2-pyridinyl]acetamide
SMILESCNc1ccc(N(C)C(C)=O)nc1
InChIInChI=1S/C9H13N3O/c1-7(13)12(3)9-5-4-8(10-2)6-11-9/h4-6,10H,1-3H3
InChIKeyQHSLUJPRSNUSKB-UHFFFAOYSA-N
MW179.22 g/mol
LogP1.11
Rot. Bonds2

About N-methyl-N-[5-(methylamino)-2-pyridinyl]acetamide

N-methyl-N-[5-(methylamino)-2-pyridinyl]acetamide (PubChem CID 59594510) has the molecular formula C9H13N3O and a molecular weight of 179.22 g/mol. Its IUPAC name is N-methyl-N-[5-(methylamino)-2-pyridinyl]acetamide.

Molecular Properties

Compound NameN-methyl-N-[5-(methylamino)-2-pyridinyl]acetamide
PubChem CID59594510
Molecular FormulaC9H13N3O
Molecular Weight179.22 g/mol
Exact Mass179.11
IUPAC NameN-methyl-N-[5-(methylamino)-2-pyridinyl]acetamide
SMILESCNc1ccc(N(C)C(C)=O)nc1
InChIInChI=1S/C9H13N3O/c1-7(13)12(3)9-5-4-8(10-2)6-11-9/h4-6,10H,1-3H3
InChIKeyQHSLUJPRSNUSKB-UHFFFAOYSA-N
XLogP1.11
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.22
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[5-(methylamino)-2-pyridinyl]acetamide?
The IUPAC name of N-methyl-N-[5-(methylamino)-2-pyridinyl]acetamide (CID 59594510) is N-methyl-N-[5-(methylamino)-2-pyridinyl]acetamide.
What is the SMILES notation for N-methyl-N-[5-(methylamino)-2-pyridinyl]acetamide?
The canonical SMILES for N-methyl-N-[5-(methylamino)-2-pyridinyl]acetamide is CNc1ccc(N(C)C(C)=O)nc1.
What is the InChIKey of N-methyl-N-[5-(methylamino)-2-pyridinyl]acetamide?
The InChIKey is QHSLUJPRSNUSKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O/c1-7(13)12(3)9-5-4-8(10-2)6-11-9/h4-6,10H,1-3H3.
What are the key properties of N-methyl-N-[5-(methylamino)-2-pyridinyl]acetamide?
N-methyl-N-[5-(methylamino)-2-pyridinyl]acetamide has a molecular weight of 179.22 g/mol, XLogP of 1.11, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[5-(methylamino)-2-pyridinyl]acetamide is sourced from PubChem (CID 59594510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).