N,N-dimethyl-2-[4-([1,2,4]triazolo[1,5-a]pyridin-6-ylamino)phenyl]acetamide

C16H17N5O — CID 157012477

IUPACN,N-dimethyl-2-[4-([1,2,4]triazolo[1,5-a]pyridin-6-ylamino)phenyl]acetamide
SMILESCN(C)C(=O)Cc1ccc(Nc2ccc3ncnn3c2)cc1
InChIInChI=1S/C16H17N5O/c1-20(2)16(22)9-12-3-5-13(6-4-12)19-14-7-8-15-17-11-18-21(15)10-14/h3-8,10-11,19H,9H2,1-2H3
InChIKeyQMUGHQKKRZDTGK-UHFFFAOYSA-N
MW295.35 g/mol
LogP2.10
Rot. Bonds4

About N,N-dimethyl-2-[4-([1,2,4]triazolo[1,5-a]pyridin-6-ylamino)phenyl]acetamide

N,N-dimethyl-2-[4-([1,2,4]triazolo[1,5-a]pyridin-6-ylamino)phenyl]acetamide (PubChem CID 157012477) has the molecular formula C16H17N5O and a molecular weight of 295.35 g/mol. Its IUPAC name is N,N-dimethyl-2-[4-([1,2,4]triazolo[1,5-a]pyridin-6-ylamino)phenyl]acetamide.

Molecular Properties

Compound NameN,N-dimethyl-2-[4-([1,2,4]triazolo[1,5-a]pyridin-6-ylamino)phenyl]acetamide
PubChem CID157012477
Molecular FormulaC16H17N5O
Molecular Weight295.35 g/mol
Exact Mass295.14
IUPAC NameN,N-dimethyl-2-[4-([1,2,4]triazolo[1,5-a]pyridin-6-ylamino)phenyl]acetamide
SMILESCN(C)C(=O)Cc1ccc(Nc2ccc3ncnn3c2)cc1
InChIInChI=1S/C16H17N5O/c1-20(2)16(22)9-12-3-5-13(6-4-12)19-14-7-8-15-17-11-18-21(15)10-14/h3-8,10-11,19H,9H2,1-2H3
InChIKeyQMUGHQKKRZDTGK-UHFFFAOYSA-N
XLogP2.10
TPSA62.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.35
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N,N-dimethyl-2-[4-[(3-methylbenzimidazol-5-yl)amino]phenyl]acetamide
CID 157016920
N,N-dimethyl-2-[4-(propan-2-ylamino)phenyl]acetamide
CID 43720790
N,N-dimethyl-2-[4-(pentan-3-ylamino)phenyl]acetamide
CID 43720783
2-[4-[(2-chloroacetyl)amino]phenyl]-N,N-dimethylacetamide
CID 43699528
methyl 3-[4-[2-(dimethylamino)-2-oxoethyl]anilino]benzoate
CID 157018002
2-[4-[3-(1-hydroxyethyl)anilino]phenyl]-N,N-dimethylacetamide
CID 157011392
N,N-dimethyl-2-(4-methylphenyl)acetamide
CID 4048798
[1,2,4]triazolo[1,5-a]pyridine-6-carbohydrazide
CID 169101289
N,N-dimethyl-[1,2,4]triazolo[1,5-a]pyridin-6-amine
CID 123664877
N,N-dimethyl-2-[4-[(3-methylcinnolin-5-yl)amino]phenyl]acetamide
CID 157020250
2-[5-[cyclopentyl(methyl)amino]-2-oxopyrazin-1-yl]-N-([1,2,4]triazolo[1,5-a]pyridin-6-yl)acetamide
CID 156808535
2-[4-[(2-bromophenyl)methylamino]phenyl]-N,N-dimethylacetamide
CID 43720767

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[4-([1,2,4]triazolo[1,5-a]pyridin-6-ylamino)phenyl]acetamide?
The IUPAC name of N,N-dimethyl-2-[4-([1,2,4]triazolo[1,5-a]pyridin-6-ylamino)phenyl]acetamide (CID 157012477) is N,N-dimethyl-2-[4-([1,2,4]triazolo[1,5-a]pyridin-6-ylamino)phenyl]acetamide.
What is the SMILES notation for N,N-dimethyl-2-[4-([1,2,4]triazolo[1,5-a]pyridin-6-ylamino)phenyl]acetamide?
The canonical SMILES for N,N-dimethyl-2-[4-([1,2,4]triazolo[1,5-a]pyridin-6-ylamino)phenyl]acetamide is CN(C)C(=O)Cc1ccc(Nc2ccc3ncnn3c2)cc1.
What is the InChIKey of N,N-dimethyl-2-[4-([1,2,4]triazolo[1,5-a]pyridin-6-ylamino)phenyl]acetamide?
The InChIKey is QMUGHQKKRZDTGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N5O/c1-20(2)16(22)9-12-3-5-13(6-4-12)19-14-7-8-15-17-11-18-21(15)10-14/h3-8,10-11,19H,9H2,1-2H3.
What are the key properties of N,N-dimethyl-2-[4-([1,2,4]triazolo[1,5-a]pyridin-6-ylamino)phenyl]acetamide?
N,N-dimethyl-2-[4-([1,2,4]triazolo[1,5-a]pyridin-6-ylamino)phenyl]acetamide has a molecular weight of 295.35 g/mol, XLogP of 2.10, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[4-([1,2,4]triazolo[1,5-a]pyridin-6-ylamino)phenyl]acetamide is sourced from PubChem (CID 157012477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).