2-[(6-amino-3-chloro-2-pyridinyl)methyl-methylamino]-N,N-dimethylacetamide

C11H17ClN4O — CID 62892874

IUPAC2-[(6-amino-3-chloro-2-pyridinyl)methyl-methylamino]-N,N-dimethylacetamide
SMILESCN(CC(=O)N(C)C)Cc1nc(N)ccc1Cl
InChIInChI=1S/C11H17ClN4O/c1-15(2)11(17)7-16(3)6-9-8(12)4-5-10(13)14-9/h4-5H,6-7H2,1-3H3,(H2,13,14)
InChIKeyHYDFOIBSRFPQQJ-UHFFFAOYSA-N
MW256.74 g/mol
LogP0.84
Rot. Bonds4

About 2-[(6-amino-3-chloro-2-pyridinyl)methyl-methylamino]-N,N-dimethylacetamide

2-[(6-amino-3-chloro-2-pyridinyl)methyl-methylamino]-N,N-dimethylacetamide (PubChem CID 62892874) has the molecular formula C11H17ClN4O and a molecular weight of 256.74 g/mol. Its IUPAC name is 2-[(6-amino-3-chloro-2-pyridinyl)methyl-methylamino]-N,N-dimethylacetamide.

Molecular Properties

Compound Name2-[(6-amino-3-chloro-2-pyridinyl)methyl-methylamino]-N,N-dimethylacetamide
PubChem CID62892874
Molecular FormulaC11H17ClN4O
Molecular Weight256.74 g/mol
Exact Mass256.11
IUPAC Name2-[(6-amino-3-chloro-2-pyridinyl)methyl-methylamino]-N,N-dimethylacetamide
SMILESCN(CC(=O)N(C)C)Cc1nc(N)ccc1Cl
InChIInChI=1S/C11H17ClN4O/c1-15(2)11(17)7-16(3)6-9-8(12)4-5-10(13)14-9/h4-5H,6-7H2,1-3H3,(H2,13,14)
InChIKeyHYDFOIBSRFPQQJ-UHFFFAOYSA-N
XLogP0.84
TPSA62.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.74
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-Chloro-6-ethylpyridin-2-amine
CID 98040720
2-[[2-[(5-chloro-2-pyridinyl)-methylamino]acetyl]-methylamino]-N-phenylacetamide
CID 51091626
6-chloro-4-methyl-1H,2H,3H,4H-pyrido[2,3-b]pyrazin-2-one
CID 55252766
6-amino-3-chloro-N,N-dimethylpyridine-2-carboxamide
CID 62154321
5-Chloro-6-[(dimethylamino)methyl]pyridin-2-amine
CID 62893036
2-[cyanomethyl(methyl)amino]-N-(6-methylpyridin-2-yl)ethanamide
CID 53560283
N-(2,6-dichloro-3-pyridyl)-2-(dimethylcarbamoylamino)acetamide
CID 86576807
2-[Butyl-[2-[(5-chloro-2-pyridinyl)amino]-2-oxoethyl]amino]acetamide
CID 47284352
2-[3-(3-chlorophenyl)-2-oxoimidazolidin-1-yl]-N-(6-methylpyridin-2-yl)acetamide
CID 49676314
1-{4-[(6-Aminopyridin-2-yl)methyl]piperazin-1-yl}ethan-1-one
CID 71683243
2-[(5-chloro-6-cyano-2-pyridinyl)amino]-N,N-diethylacetamide
CID 72020288
5-chloro-N-[[(2S)-1,4-dimethylpiperazin-2-yl]methyl]-6-methylpyridin-2-amine
CID 164641343

Frequently Asked Questions

What is the IUPAC name of 2-[(6-amino-3-chloro-2-pyridinyl)methyl-methylamino]-N,N-dimethylacetamide?
The IUPAC name of 2-[(6-amino-3-chloro-2-pyridinyl)methyl-methylamino]-N,N-dimethylacetamide (CID 62892874) is 2-[(6-amino-3-chloro-2-pyridinyl)methyl-methylamino]-N,N-dimethylacetamide.
What is the SMILES notation for 2-[(6-amino-3-chloro-2-pyridinyl)methyl-methylamino]-N,N-dimethylacetamide?
The canonical SMILES for 2-[(6-amino-3-chloro-2-pyridinyl)methyl-methylamino]-N,N-dimethylacetamide is CN(CC(=O)N(C)C)Cc1nc(N)ccc1Cl.
What is the InChIKey of 2-[(6-amino-3-chloro-2-pyridinyl)methyl-methylamino]-N,N-dimethylacetamide?
The InChIKey is HYDFOIBSRFPQQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17ClN4O/c1-15(2)11(17)7-16(3)6-9-8(12)4-5-10(13)14-9/h4-5H,6-7H2,1-3H3,(H2,13,14).
What are the key properties of 2-[(6-amino-3-chloro-2-pyridinyl)methyl-methylamino]-N,N-dimethylacetamide?
2-[(6-amino-3-chloro-2-pyridinyl)methyl-methylamino]-N,N-dimethylacetamide has a molecular weight of 256.74 g/mol, XLogP of 0.84, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-amino-3-chloro-2-pyridinyl)methyl-methylamino]-N,N-dimethylacetamide is sourced from PubChem (CID 62892874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).