2,2-dimethyl-N-[2-oxo-2-(4-propan-2-yloxyanilino)ethyl]propanamide

C16H24N2O3 — CID 112999062

IUPAC2,2-dimethyl-N-[2-oxo-2-(4-propan-2-yloxyanilino)ethyl]propanamide
SMILESCC(C)Oc1ccc(NC(=O)CNC(=O)C(C)(C)C)cc1
InChIInChI=1S/C16H24N2O3/c1-11(2)21-13-8-6-12(7-9-13)18-14(19)10-17-15(20)16(3,4)5/h6-9,11H,10H2,1-5H3,(H,17,20)(H,18,19)
InChIKeyLPLHEDDAFRBUTI-UHFFFAOYSA-N
MW292.38 g/mol
LogP2.57
Rot. Bonds5

About 2,2-dimethyl-N-[2-oxo-2-(4-propan-2-yloxyanilino)ethyl]propanamide

2,2-dimethyl-N-[2-oxo-2-(4-propan-2-yloxyanilino)ethyl]propanamide (PubChem CID 112999062) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is 2,2-dimethyl-N-[2-oxo-2-(4-propan-2-yloxyanilino)ethyl]propanamide.

Molecular Properties

Compound Name2,2-dimethyl-N-[2-oxo-2-(4-propan-2-yloxyanilino)ethyl]propanamide
PubChem CID112999062
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC Name2,2-dimethyl-N-[2-oxo-2-(4-propan-2-yloxyanilino)ethyl]propanamide
SMILESCC(C)Oc1ccc(NC(=O)CNC(=O)C(C)(C)C)cc1
InChIInChI=1S/C16H24N2O3/c1-11(2)21-13-8-6-12(7-9-13)18-14(19)10-17-15(20)16(3,4)5/h6-9,11H,10H2,1-5H3,(H,17,20)(H,18,19)
InChIKeyLPLHEDDAFRBUTI-UHFFFAOYSA-N
XLogP2.57
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(4-methoxyanilino)-2-oxoethyl]-2,2-dimethylpropanamide
CID 771979
N-[2-oxo-2-(4-propan-2-yloxyanilino)ethyl]propanamide
CID 47415261
2-(4-acetamidoanilino)-N-(4-propan-2-yloxyphenyl)acetamide
CID 54809144
N-[4-[[2-(4-propan-2-yloxyanilino)acetyl]amino]phenyl]propanamide
CID 54822614
N-[2-(4-tert-butylanilino)-2-oxoethyl]-2,2-dimethylpropanamide
CID 36860148
N,N'-bis(4-propan-2-yloxyphenyl)butanediamide
CID 17340345
N-[2-(4-bromoanilino)-2-oxoethyl]-2,2-dimethylpropanamide
CID 36899593
2-(3-propan-2-yloxyanilino)-N-(4-propan-2-yloxyphenyl)acetamide
CID 54829870
N-[2-[[amino-(4-propan-2-yloxyanilino)methylidene]amino]ethyl]-2,2-dimethylpropanamide
CID 111095030
3-oxo-N-(4-propan-2-yloxyphenyl)butanamide
CID 28969935
N-(3,5-dimethylphenyl)-2-(4-propan-2-yloxyanilino)acetamide
CID 54822316
2-(2-propan-2-yloxyanilino)-N-(4-propan-2-yloxyphenyl)acetamide
CID 54828741

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-[2-oxo-2-(4-propan-2-yloxyanilino)ethyl]propanamide?
The IUPAC name of 2,2-dimethyl-N-[2-oxo-2-(4-propan-2-yloxyanilino)ethyl]propanamide (CID 112999062) is 2,2-dimethyl-N-[2-oxo-2-(4-propan-2-yloxyanilino)ethyl]propanamide.
What is the SMILES notation for 2,2-dimethyl-N-[2-oxo-2-(4-propan-2-yloxyanilino)ethyl]propanamide?
The canonical SMILES for 2,2-dimethyl-N-[2-oxo-2-(4-propan-2-yloxyanilino)ethyl]propanamide is CC(C)Oc1ccc(NC(=O)CNC(=O)C(C)(C)C)cc1.
What is the InChIKey of 2,2-dimethyl-N-[2-oxo-2-(4-propan-2-yloxyanilino)ethyl]propanamide?
The InChIKey is LPLHEDDAFRBUTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-11(2)21-13-8-6-12(7-9-13)18-14(19)10-17-15(20)16(3,4)5/h6-9,11H,10H2,1-5H3,(H,17,20)(H,18,19).
What are the key properties of 2,2-dimethyl-N-[2-oxo-2-(4-propan-2-yloxyanilino)ethyl]propanamide?
2,2-dimethyl-N-[2-oxo-2-(4-propan-2-yloxyanilino)ethyl]propanamide has a molecular weight of 292.38 g/mol, XLogP of 2.57, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-[2-oxo-2-(4-propan-2-yloxyanilino)ethyl]propanamide is sourced from PubChem (CID 112999062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).