N-[2-methyl-3-[[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]phenyl]propanamide

C16H24N2O3 — CID 115949978

IUPACN-[2-methyl-3-[[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]phenyl]propanamide
SMILESCCC(=O)Nc1cccc(NC(=O)COC(C)(C)C)c1C
InChIInChI=1S/C16H24N2O3/c1-6-14(19)17-12-8-7-9-13(11(12)2)18-15(20)10-21-16(3,4)5/h7-9H,6,10H2,1-5H3,(H,17,19)(H,18,20)
InChIKeySAUHSDMHYGKVJJ-UHFFFAOYSA-N
MW292.38 g/mol
LogP3.10
Rot. Bonds5

About N-[2-methyl-3-[[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]phenyl]propanamide

N-[2-methyl-3-[[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]phenyl]propanamide (PubChem CID 115949978) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is N-[2-methyl-3-[[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]phenyl]propanamide.

Molecular Properties

Compound NameN-[2-methyl-3-[[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]phenyl]propanamide
PubChem CID115949978
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC NameN-[2-methyl-3-[[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]phenyl]propanamide
SMILESCCC(=O)Nc1cccc(NC(=O)COC(C)(C)C)c1C
InChIInChI=1S/C16H24N2O3/c1-6-14(19)17-12-8-7-9-13(11(12)2)18-15(20)10-21-16(3,4)5/h7-9H,6,10H2,1-5H3,(H,17,19)(H,18,20)
InChIKeySAUHSDMHYGKVJJ-UHFFFAOYSA-N
XLogP3.10
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 ≤ 53.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-3-[[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]benzoic acid
CID 112602120
N-[2-methyl-3-[(2-phenoxyacetyl)amino]phenyl]propanamide
CID 38300689
N-(3-chloro-2-fluorophenyl)-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112604948
3-chloro-2,2-dimethyl-N-[2-methyl-3-(propanoylamino)phenyl]propanamide
CID 63680386
N-[3-[[2-(4-methoxyphenoxy)acetyl]amino]-2-methylphenyl]propanamide
CID 38300469
N-[3-[(3-methoxy-2-methylpropyl)amino]-2-methylphenyl]propanamide
CID 116501066
N-[2-methyl-3-(propanoylamino)phenyl]benzamide
CID 38300041
N-(2-bromo-3-pyridinyl)-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 103943345
N-[3-[[2-(3-chloro-2-methylanilino)acetyl]amino]-2-methylphenyl]propanamide
CID 54814911
N-[3-[[2-(2-chloroanilino)acetyl]amino]-2-methylphenyl]propanamide
CID 54810419
N-[2-(methoxymethyl)phenyl]-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112604453
(E)-2-methyl-N-[2-methyl-3-(propanoylamino)phenyl]pent-2-enamide
CID 94151525

Frequently Asked Questions

What is the IUPAC name of N-[2-methyl-3-[[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]phenyl]propanamide?
The IUPAC name of N-[2-methyl-3-[[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]phenyl]propanamide (CID 115949978) is N-[2-methyl-3-[[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]phenyl]propanamide.
What is the SMILES notation for N-[2-methyl-3-[[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]phenyl]propanamide?
The canonical SMILES for N-[2-methyl-3-[[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]phenyl]propanamide is CCC(=O)Nc1cccc(NC(=O)COC(C)(C)C)c1C.
What is the InChIKey of N-[2-methyl-3-[[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]phenyl]propanamide?
The InChIKey is SAUHSDMHYGKVJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-6-14(19)17-12-8-7-9-13(11(12)2)18-15(20)10-21-16(3,4)5/h7-9H,6,10H2,1-5H3,(H,17,19)(H,18,20).
What are the key properties of N-[2-methyl-3-[[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]phenyl]propanamide?
N-[2-methyl-3-[[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]phenyl]propanamide has a molecular weight of 292.38 g/mol, XLogP of 3.10, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methyl-3-[[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]phenyl]propanamide is sourced from PubChem (CID 115949978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).