N-(1-phenylpropyl)-2-(2-propan-2-yloxyanilino)acetamide

C20H26N2O2 — CID 54831184

IUPACN-(1-phenylpropyl)-2-(2-propan-2-yloxyanilino)acetamide
SMILESCCC(NC(=O)CNc1ccccc1OC(C)C)c1ccccc1
InChIInChI=1S/C20H26N2O2/c1-4-17(16-10-6-5-7-11-16)22-20(23)14-21-18-12-8-9-13-19(18)24-15(2)3/h5-13,15,17,21H,4,14H2,1-3H3,(H,22,23)
InChIKeyIWOPYXZHQPHQRS-UHFFFAOYSA-N
MW326.44 g/mol
LogP4.15
Rot. Bonds8

About N-(1-phenylpropyl)-2-(2-propan-2-yloxyanilino)acetamide

N-(1-phenylpropyl)-2-(2-propan-2-yloxyanilino)acetamide (PubChem CID 54831184) has the molecular formula C20H26N2O2 and a molecular weight of 326.44 g/mol. Its IUPAC name is N-(1-phenylpropyl)-2-(2-propan-2-yloxyanilino)acetamide.

Molecular Properties

Compound NameN-(1-phenylpropyl)-2-(2-propan-2-yloxyanilino)acetamide
PubChem CID54831184
Molecular FormulaC20H26N2O2
Molecular Weight326.44 g/mol
Exact Mass326.20
IUPAC NameN-(1-phenylpropyl)-2-(2-propan-2-yloxyanilino)acetamide
SMILESCCC(NC(=O)CNc1ccccc1OC(C)C)c1ccccc1
InChIInChI=1S/C20H26N2O2/c1-4-17(16-10-6-5-7-11-16)22-20(23)14-21-18-12-8-9-13-19(18)24-15(2)3/h5-13,15,17,21H,4,14H2,1-3H3,(H,22,23)
InChIKeyIWOPYXZHQPHQRS-UHFFFAOYSA-N
XLogP4.15
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.44
LogP ≤ 54.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(2-methylprop-2-enoxy)anilino]-N-(1-phenylpropyl)acetamide
CID 54825728
N-(1-phenylpropyl)-2-propan-2-yloxybenzamide
CID 43911562
2-(2,3-dichloroanilino)-N-(1-phenylpropyl)acetamide
CID 54815882
2-(2-propan-2-yloxyanilino)-N-(4-propan-2-yloxyphenyl)acetamide
CID 54828741
2-(naphthalen-1-ylamino)-N-(2-propan-2-yloxyphenyl)acetamide
CID 54809130
N-(2-phenylmethoxyphenyl)-2-(2-propan-2-yloxyanilino)acetamide
CID 54828582
3-(2-propan-2-yloxyanilino)butanoic acid
CID 112510100
2-(4-bromoanilino)-N-(1-phenylpropyl)acetamide
CID 54811171
2-[2-(2-phenoxyethoxy)anilino]-N-(2-propan-2-yloxyphenyl)acetamide
CID 54827093
2-(butan-2-ylamino)-N-(2-propan-2-yloxyphenyl)acetamide
CID 54829029
N-[(1S)-1-phenylpropyl]-4-propan-2-yloxybenzamide
CID 28632520
2-(2-propan-2-yloxyanilino)-N-[(4-propan-2-yloxyphenyl)methyl]acetamide
CID 54831154

Frequently Asked Questions

What is the IUPAC name of N-(1-phenylpropyl)-2-(2-propan-2-yloxyanilino)acetamide?
The IUPAC name of N-(1-phenylpropyl)-2-(2-propan-2-yloxyanilino)acetamide (CID 54831184) is N-(1-phenylpropyl)-2-(2-propan-2-yloxyanilino)acetamide.
What is the SMILES notation for N-(1-phenylpropyl)-2-(2-propan-2-yloxyanilino)acetamide?
The canonical SMILES for N-(1-phenylpropyl)-2-(2-propan-2-yloxyanilino)acetamide is CCC(NC(=O)CNc1ccccc1OC(C)C)c1ccccc1.
What is the InChIKey of N-(1-phenylpropyl)-2-(2-propan-2-yloxyanilino)acetamide?
The InChIKey is IWOPYXZHQPHQRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O2/c1-4-17(16-10-6-5-7-11-16)22-20(23)14-21-18-12-8-9-13-19(18)24-15(2)3/h5-13,15,17,21H,4,14H2,1-3H3,(H,22,23).
What are the key properties of N-(1-phenylpropyl)-2-(2-propan-2-yloxyanilino)acetamide?
N-(1-phenylpropyl)-2-(2-propan-2-yloxyanilino)acetamide has a molecular weight of 326.44 g/mol, XLogP of 4.15, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-phenylpropyl)-2-(2-propan-2-yloxyanilino)acetamide is sourced from PubChem (CID 54831184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).