N'-(6-methyl-2-pyridinyl)butanediamide

C10H13N3O2 — CID 91273300

IUPACN'-(6-methyl-2-pyridinyl)butanediamide
SMILESCc1cccc(NC(=O)CCC(N)=O)n1
InChIInChI=1S/C10H13N3O2/c1-7-3-2-4-9(12-7)13-10(15)6-5-8(11)14/h2-4H,5-6H2,1H3,(H2,11,14)(H,12,13,15)
InChIKeyLLEGMXAVUIWBRY-UHFFFAOYSA-N
MW207.23 g/mol
LogP0.59
Rot. Bonds4

About N'-(6-methyl-2-pyridinyl)butanediamide

N'-(6-methyl-2-pyridinyl)butanediamide (PubChem CID 91273300) has the molecular formula C10H13N3O2 and a molecular weight of 207.23 g/mol. Its IUPAC name is N'-(6-methyl-2-pyridinyl)butanediamide.

Molecular Properties

Compound NameN'-(6-methyl-2-pyridinyl)butanediamide
PubChem CID91273300
Molecular FormulaC10H13N3O2
Molecular Weight207.23 g/mol
Exact Mass207.10
IUPAC NameN'-(6-methyl-2-pyridinyl)butanediamide
SMILESCc1cccc(NC(=O)CCC(N)=O)n1
InChIInChI=1S/C10H13N3O2/c1-7-3-2-4-9(12-7)13-10(15)6-5-8(11)14/h2-4H,5-6H2,1H3,(H2,11,14)(H,12,13,15)
InChIKeyLLEGMXAVUIWBRY-UHFFFAOYSA-N
XLogP0.59
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.23
LogP ≤ 50.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

ethane;N-(6-methyl-2-pyridinyl)butanamide
CID 143608787
N-(6-methyl-2-pyridinyl)propanamide
CID 5057760
5-amino-N-(6-methyl-2-pyridinyl)hexanamide
CID 82849039
N-(6-methyl-2-pyridinyl)-3-pyridin-4-ylpropanamide
CID 46480468
ethyl N-(6-methyl-2-pyridinyl)carbamate
CID 5197559
N-(6-methyl-2-pyridinyl)-3-phenylsulfanylpropanamide
CID 23804504
3-[[amino-(2,6-diethylanilino)methylidene]amino]-N-(6-methyl-2-pyridinyl)propanamide
CID 111074213
N-(6-methyl-2-pyridinyl)-3-thiophen-3-ylpropanamide
CID 18107239
2-amino-N-(6-methyl-2-pyridinyl)propanamide
CID 60731757
2-[2-[(6-methyl-2-pyridinyl)amino]-2-oxoethoxy]acetic acid
CID 1431338
N'-(2-ethyl-6-methylphenyl)butanediamide
CID 82041304
N-(6-methyl-2-pyridinyl)-3-(2,2,2-trifluoroethylcarbamoylamino)propanamide
CID 86861206

Frequently Asked Questions

What is the IUPAC name of N'-(6-methyl-2-pyridinyl)butanediamide?
The IUPAC name of N'-(6-methyl-2-pyridinyl)butanediamide (CID 91273300) is N'-(6-methyl-2-pyridinyl)butanediamide.
What is the SMILES notation for N'-(6-methyl-2-pyridinyl)butanediamide?
The canonical SMILES for N'-(6-methyl-2-pyridinyl)butanediamide is Cc1cccc(NC(=O)CCC(N)=O)n1.
What is the InChIKey of N'-(6-methyl-2-pyridinyl)butanediamide?
The InChIKey is LLEGMXAVUIWBRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O2/c1-7-3-2-4-9(12-7)13-10(15)6-5-8(11)14/h2-4H,5-6H2,1H3,(H2,11,14)(H,12,13,15).
What are the key properties of N'-(6-methyl-2-pyridinyl)butanediamide?
N'-(6-methyl-2-pyridinyl)butanediamide has a molecular weight of 207.23 g/mol, XLogP of 0.59, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(6-methyl-2-pyridinyl)butanediamide is sourced from PubChem (CID 91273300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).