N-ethyl-N-methyl-2-[(3-methyl-4-pyridinyl)methylamino]acetamide

C12H19N3O — CID 114699647

IUPACN-ethyl-N-methyl-2-[(3-methyl-4-pyridinyl)methylamino]acetamide
SMILESCCN(C)C(=O)CNCc1ccncc1C
InChIInChI=1S/C12H19N3O/c1-4-15(3)12(16)9-14-8-11-5-6-13-7-10(11)2/h5-7,14H,4,8-9H2,1-3H3
InChIKeyRIYQSTICHRWOGP-UHFFFAOYSA-N
MW221.30 g/mol
LogP0.96
Rot. Bonds5

About N-ethyl-N-methyl-2-[(3-methyl-4-pyridinyl)methylamino]acetamide

N-ethyl-N-methyl-2-[(3-methyl-4-pyridinyl)methylamino]acetamide (PubChem CID 114699647) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is N-ethyl-N-methyl-2-[(3-methyl-4-pyridinyl)methylamino]acetamide.

Molecular Properties

Compound NameN-ethyl-N-methyl-2-[(3-methyl-4-pyridinyl)methylamino]acetamide
PubChem CID114699647
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC NameN-ethyl-N-methyl-2-[(3-methyl-4-pyridinyl)methylamino]acetamide
SMILESCCN(C)C(=O)CNCc1ccncc1C
InChIInChI=1S/C12H19N3O/c1-4-15(3)12(16)9-14-8-11-5-6-13-7-10(11)2/h5-7,14H,4,8-9H2,1-3H3
InChIKeyRIYQSTICHRWOGP-UHFFFAOYSA-N
XLogP0.96
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-dimethyl-2-[(3-methyl-4-pyridinyl)methylamino]acetamide
CID 114699849
N,N-dimethyl-2-(3-methyl-4-pyridinyl)acetamide
CID 130131962
2-[(2,3-dihydroxyphenyl)methylamino]-N-ethyl-N-methylacetamide
CID 114132352
2-[(2-chlorophenyl)methylamino]-N-ethyl-N-methylacetamide
CID 43309591
N-ethyl-2-[(2-fluoro-5-methylphenyl)methylamino]-N-methylacetamide
CID 104923539
N,N-diethyl-2-[(2-methylphenyl)methylamino]acetamide
CID 60695385
2-methyl-3-[(3-methyl-4-pyridinyl)methylamino]propanoic acid
CID 114699734
N-ethyl-N-methyl-2-[(3-methylimidazol-4-yl)methylamino]acetamide
CID 104923403
3-chloro-N-[2-[ethyl(methyl)amino]-2-oxoethyl]pyridine-4-carboxamide
CID 104920297
3-[[(3-methyl-4-pyridinyl)methylamino]methyl]thiophene-2-carboxylic acid
CID 103267005
2-ethoxy-N-[(3-methyl-4-pyridinyl)methyl]ethanamine
CID 114699562
2-[(4-chloro-2-methylphenyl)methylamino]-N,N-diethylacetamide
CID 104854061

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-methyl-2-[(3-methyl-4-pyridinyl)methylamino]acetamide?
The IUPAC name of N-ethyl-N-methyl-2-[(3-methyl-4-pyridinyl)methylamino]acetamide (CID 114699647) is N-ethyl-N-methyl-2-[(3-methyl-4-pyridinyl)methylamino]acetamide.
What is the SMILES notation for N-ethyl-N-methyl-2-[(3-methyl-4-pyridinyl)methylamino]acetamide?
The canonical SMILES for N-ethyl-N-methyl-2-[(3-methyl-4-pyridinyl)methylamino]acetamide is CCN(C)C(=O)CNCc1ccncc1C.
What is the InChIKey of N-ethyl-N-methyl-2-[(3-methyl-4-pyridinyl)methylamino]acetamide?
The InChIKey is RIYQSTICHRWOGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-4-15(3)12(16)9-14-8-11-5-6-13-7-10(11)2/h5-7,14H,4,8-9H2,1-3H3.
What are the key properties of N-ethyl-N-methyl-2-[(3-methyl-4-pyridinyl)methylamino]acetamide?
N-ethyl-N-methyl-2-[(3-methyl-4-pyridinyl)methylamino]acetamide has a molecular weight of 221.30 g/mol, XLogP of 0.96, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-methyl-2-[(3-methyl-4-pyridinyl)methylamino]acetamide is sourced from PubChem (CID 114699647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).