2-(butan-2-ylamino)-N-(4,6-dimethyl-2-pyridinyl)acetamide

C13H21N3O — CID 114932408

IUPAC2-(butan-2-ylamino)-N-(4,6-dimethyl-2-pyridinyl)acetamide
SMILESCCC(C)NCC(=O)Nc1cc(C)cc(C)n1
InChIInChI=1S/C13H21N3O/c1-5-10(3)14-8-13(17)16-12-7-9(2)6-11(4)15-12/h6-7,10,14H,5,8H2,1-4H3,(H,15,16,17)
InChIKeyBBKBTUGTOWYKEJ-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.03
Rot. Bonds5

About 2-(butan-2-ylamino)-N-(4,6-dimethyl-2-pyridinyl)acetamide

2-(butan-2-ylamino)-N-(4,6-dimethyl-2-pyridinyl)acetamide (PubChem CID 114932408) has the molecular formula C13H21N3O and a molecular weight of 235.33 g/mol. Its IUPAC name is 2-(butan-2-ylamino)-N-(4,6-dimethyl-2-pyridinyl)acetamide.

Molecular Properties

Compound Name2-(butan-2-ylamino)-N-(4,6-dimethyl-2-pyridinyl)acetamide
PubChem CID114932408
Molecular FormulaC13H21N3O
Molecular Weight235.33 g/mol
Exact Mass235.17
IUPAC Name2-(butan-2-ylamino)-N-(4,6-dimethyl-2-pyridinyl)acetamide
SMILESCCC(C)NCC(=O)Nc1cc(C)cc(C)n1
InChIInChI=1S/C13H21N3O/c1-5-10(3)14-8-13(17)16-12-7-9(2)6-11(4)15-12/h6-7,10,14H,5,8H2,1-4H3,(H,15,16,17)
InChIKeyBBKBTUGTOWYKEJ-UHFFFAOYSA-N
XLogP2.03
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-N-(4,6-dimethyl-2-pyridinyl)acetamide
CID 4199160
CID 10084917
CID 10084917
N-(4,6-dimethyl-2-pyridinyl)hexanamide
CID 5075598
N-(4,6-dimethyl-2-pyridinyl)nonanamide
CID 4047413
2-(butan-2-ylamino)-N-(2,4,6-trichlorophenyl)acetamide
CID 60646938
6-amino-N-(4,6-dimethyl-2-pyridinyl)-4-methylhexanamide
CID 114932264
2-(butan-2-ylamino)-N-(2,6-dimethylphenyl)acetamide
CID 21430532
N-(4,6-dimethyl-2-pyridinyl)-2-(4-methylphenyl)acetamide
CID 17148768
2-(butan-2-ylamino)-N-pyridin-2-ylacetamide
CID 60852283
2-[[(2S)-butan-2-yl]amino]-N-(3-methylphenyl)acetamide
CID 2386923
2-(butan-2-ylamino)-N-(1,2-oxazol-3-yl)acetamide
CID 42656286
N-(4,6-dimethyl-2-pyridinyl)-3-pyrrol-1-ylbutanamide
CID 174332471

Frequently Asked Questions

What is the IUPAC name of 2-(butan-2-ylamino)-N-(4,6-dimethyl-2-pyridinyl)acetamide?
The IUPAC name of 2-(butan-2-ylamino)-N-(4,6-dimethyl-2-pyridinyl)acetamide (CID 114932408) is 2-(butan-2-ylamino)-N-(4,6-dimethyl-2-pyridinyl)acetamide.
What is the SMILES notation for 2-(butan-2-ylamino)-N-(4,6-dimethyl-2-pyridinyl)acetamide?
The canonical SMILES for 2-(butan-2-ylamino)-N-(4,6-dimethyl-2-pyridinyl)acetamide is CCC(C)NCC(=O)Nc1cc(C)cc(C)n1.
What is the InChIKey of 2-(butan-2-ylamino)-N-(4,6-dimethyl-2-pyridinyl)acetamide?
The InChIKey is BBKBTUGTOWYKEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O/c1-5-10(3)14-8-13(17)16-12-7-9(2)6-11(4)15-12/h6-7,10,14H,5,8H2,1-4H3,(H,15,16,17).
What are the key properties of 2-(butan-2-ylamino)-N-(4,6-dimethyl-2-pyridinyl)acetamide?
2-(butan-2-ylamino)-N-(4,6-dimethyl-2-pyridinyl)acetamide has a molecular weight of 235.33 g/mol, XLogP of 2.03, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(butan-2-ylamino)-N-(4,6-dimethyl-2-pyridinyl)acetamide is sourced from PubChem (CID 114932408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).