N-(1,5-diethyl-2-methyl-2H-pyridin-3-yl)acetamide

C12H20N2O — CID 57008675

IUPACN-(1,5-diethyl-2-methyl-2H-pyridin-3-yl)acetamide
SMILESCCC1=CN(CC)C(C)C(NC(C)=O)=C1
InChIInChI=1S/C12H20N2O/c1-5-11-7-12(13-10(4)15)9(3)14(6-2)8-11/h7-9H,5-6H2,1-4H3,(H,13,15)
InChIKeyYWIBJUDADMAJRW-UHFFFAOYSA-N
MW208.30 g/mol
LogP2.02
Rot. Bonds3

About N-(1,5-diethyl-2-methyl-2H-pyridin-3-yl)acetamide

N-(1,5-diethyl-2-methyl-2H-pyridin-3-yl)acetamide (PubChem CID 57008675) has the molecular formula C12H20N2O and a molecular weight of 208.30 g/mol. Its IUPAC name is N-(1,5-diethyl-2-methyl-2H-pyridin-3-yl)acetamide.

Molecular Properties

Compound NameN-(1,5-diethyl-2-methyl-2H-pyridin-3-yl)acetamide
PubChem CID57008675
Molecular FormulaC12H20N2O
Molecular Weight208.30 g/mol
Exact Mass208.16
IUPAC NameN-(1,5-diethyl-2-methyl-2H-pyridin-3-yl)acetamide
SMILESCCC1=CN(CC)C(C)C(NC(C)=O)=C1
InChIInChI=1S/C12H20N2O/c1-5-11-7-12(13-10(4)15)9(3)14(6-2)8-11/h7-9H,5-6H2,1-4H3,(H,13,15)
InChIKeyYWIBJUDADMAJRW-UHFFFAOYSA-N
XLogP2.02
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.30
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(1,5-diethyl-2-methyl-2H-pyridin-3-yl)acetamide?
The IUPAC name of N-(1,5-diethyl-2-methyl-2H-pyridin-3-yl)acetamide (CID 57008675) is N-(1,5-diethyl-2-methyl-2H-pyridin-3-yl)acetamide.
What is the SMILES notation for N-(1,5-diethyl-2-methyl-2H-pyridin-3-yl)acetamide?
The canonical SMILES for N-(1,5-diethyl-2-methyl-2H-pyridin-3-yl)acetamide is CCC1=CN(CC)C(C)C(NC(C)=O)=C1.
What is the InChIKey of N-(1,5-diethyl-2-methyl-2H-pyridin-3-yl)acetamide?
The InChIKey is YWIBJUDADMAJRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O/c1-5-11-7-12(13-10(4)15)9(3)14(6-2)8-11/h7-9H,5-6H2,1-4H3,(H,13,15).
What are the key properties of N-(1,5-diethyl-2-methyl-2H-pyridin-3-yl)acetamide?
N-(1,5-diethyl-2-methyl-2H-pyridin-3-yl)acetamide has a molecular weight of 208.30 g/mol, XLogP of 2.02, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,5-diethyl-2-methyl-2H-pyridin-3-yl)acetamide is sourced from PubChem (CID 57008675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).