N-tert-butyl-2-[(5-chloro-2-pyridinyl)amino]acetamide

C11H16ClN3O — CID 79035029

IUPACN-tert-butyl-2-[(5-chloro-2-pyridinyl)amino]acetamide
SMILESCC(C)(C)NC(=O)CNc1ccc(Cl)cn1
InChIInChI=1S/C11H16ClN3O/c1-11(2,3)15-10(16)7-14-9-5-4-8(12)6-13-9/h4-6H,7H2,1-3H3,(H,13,14)(H,15,16)
InChIKeyWZMUSUVBWYEWTM-UHFFFAOYSA-N
MW241.72 g/mol
LogP2.06
Rot. Bonds3

About N-tert-butyl-2-[(5-chloro-2-pyridinyl)amino]acetamide

N-tert-butyl-2-[(5-chloro-2-pyridinyl)amino]acetamide (PubChem CID 79035029) has the molecular formula C11H16ClN3O and a molecular weight of 241.72 g/mol. Its IUPAC name is N-tert-butyl-2-[(5-chloro-2-pyridinyl)amino]acetamide.

Molecular Properties

Compound NameN-tert-butyl-2-[(5-chloro-2-pyridinyl)amino]acetamide
PubChem CID79035029
Molecular FormulaC11H16ClN3O
Molecular Weight241.72 g/mol
Exact Mass241.10
IUPAC NameN-tert-butyl-2-[(5-chloro-2-pyridinyl)amino]acetamide
SMILESCC(C)(C)NC(=O)CNc1ccc(Cl)cn1
InChIInChI=1S/C11H16ClN3O/c1-11(2,3)15-10(16)7-14-9-5-4-8(12)6-13-9/h4-6H,7H2,1-3H3,(H,13,14)(H,15,16)
InChIKeyWZMUSUVBWYEWTM-UHFFFAOYSA-N
XLogP2.06
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.72
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-tert-butyl-2-[(5-piperidin-1-ylsulfonyl-2-pyridinyl)amino]acetamide
CID 9024930
3-[(5-chloro-2-pyridinyl)amino]-2-methylpropanoic acid
CID 82316740
N-tert-butyl-2-(pyrido[2,3-b]pyrazin-6-ylamino)acetamide
CID 78988508
N-[2-(tert-butylamino)-2-oxoethyl]-6-(propylamino)pyridine-3-carboxamide
CID 115357188
N-tert-butyl-2-[(5-methyl-4-nitro-2-pyridinyl)amino]acetamide
CID 83268004
2-(2-bromo-5-chloroanilino)-N-tert-butylacetamide
CID 81281028
2-[(5-amino-6-methyl-2-pyridinyl)amino]-N-tert-butylacetamide
CID 115356046
N-tert-butyl-2-[(3-chloro-2-pyridinyl)amino]acetamide
CID 115279391
N-[4-[2-[(5-chloro-2-pyridinyl)amino]-2-oxoethyl]sulfanylphenyl]-3,3-dimethylbutanamide
CID 19630279
N'-(5-chloro-2-pyridinyl)-2,2-dimethylpropane-1,3-diamine
CID 115366147
N-(5-chloro-2-pyridinyl)-2-(2,3-dichloroanilino)acetamide
CID 78821308
4-[(5-chloro-2-pyridinyl)amino]butanoic acid
CID 24698899

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-[(5-chloro-2-pyridinyl)amino]acetamide?
The IUPAC name of N-tert-butyl-2-[(5-chloro-2-pyridinyl)amino]acetamide (CID 79035029) is N-tert-butyl-2-[(5-chloro-2-pyridinyl)amino]acetamide.
What is the SMILES notation for N-tert-butyl-2-[(5-chloro-2-pyridinyl)amino]acetamide?
The canonical SMILES for N-tert-butyl-2-[(5-chloro-2-pyridinyl)amino]acetamide is CC(C)(C)NC(=O)CNc1ccc(Cl)cn1.
What is the InChIKey of N-tert-butyl-2-[(5-chloro-2-pyridinyl)amino]acetamide?
The InChIKey is WZMUSUVBWYEWTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16ClN3O/c1-11(2,3)15-10(16)7-14-9-5-4-8(12)6-13-9/h4-6H,7H2,1-3H3,(H,13,14)(H,15,16).
What are the key properties of N-tert-butyl-2-[(5-chloro-2-pyridinyl)amino]acetamide?
N-tert-butyl-2-[(5-chloro-2-pyridinyl)amino]acetamide has a molecular weight of 241.72 g/mol, XLogP of 2.06, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-[(5-chloro-2-pyridinyl)amino]acetamide is sourced from PubChem (CID 79035029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).