N-(1-methoxypropan-2-yl)-2-(4-propan-2-yloxyanilino)acetamide

C15H24N2O3 — CID 61487924

IUPACN-(1-methoxypropan-2-yl)-2-(4-propan-2-yloxyanilino)acetamide
SMILESCOCC(C)NC(=O)CNc1ccc(OC(C)C)cc1
InChIInChI=1S/C15H24N2O3/c1-11(2)20-14-7-5-13(6-8-14)16-9-15(18)17-12(3)10-19-4/h5-8,11-12,16H,9-10H2,1-4H3,(H,17,18)
InChIKeyIHNXMPZLFSLLFX-UHFFFAOYSA-N
MW280.37 g/mol
LogP2.04
Rot. Bonds8

About N-(1-methoxypropan-2-yl)-2-(4-propan-2-yloxyanilino)acetamide

N-(1-methoxypropan-2-yl)-2-(4-propan-2-yloxyanilino)acetamide (PubChem CID 61487924) has the molecular formula C15H24N2O3 and a molecular weight of 280.37 g/mol. Its IUPAC name is N-(1-methoxypropan-2-yl)-2-(4-propan-2-yloxyanilino)acetamide.

Molecular Properties

Compound NameN-(1-methoxypropan-2-yl)-2-(4-propan-2-yloxyanilino)acetamide
PubChem CID61487924
Molecular FormulaC15H24N2O3
Molecular Weight280.37 g/mol
Exact Mass280.18
IUPAC NameN-(1-methoxypropan-2-yl)-2-(4-propan-2-yloxyanilino)acetamide
SMILESCOCC(C)NC(=O)CNc1ccc(OC(C)C)cc1
InChIInChI=1S/C15H24N2O3/c1-11(2)20-14-7-5-13(6-8-14)16-9-15(18)17-12(3)10-19-4/h5-8,11-12,16H,9-10H2,1-4H3,(H,17,18)
InChIKeyIHNXMPZLFSLLFX-UHFFFAOYSA-N
XLogP2.04
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}

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Related Compounds

2-[4-(diethylamino)anilino]-N-(1-methoxypropan-2-yl)acetamide
CID 60685420
N-[4-[[2-(4-propan-2-yloxyanilino)acetyl]amino]phenyl]propanamide
CID 54822614
butyl 4-[[2-(1-methoxypropan-2-ylamino)-2-oxoethyl]amino]benzoate
CID 51252606
2-[(6-bromonaphthalen-2-yl)amino]-N-(1-methoxypropan-2-yl)acetamide
CID 80973341
2-(4-propan-2-yloxyanilino)acetic acid
CID 28969819
N-(1-methoxypropan-2-yl)-4-propan-2-yloxyaniline
CID 62535634
2-(4-acetamidoanilino)-N-(4-propan-2-yloxyphenyl)acetamide
CID 54809144
2-(3,4-dicyanoanilino)-N-(1-methoxypropan-2-yl)acetamide
CID 107789246
N-(3,5-dimethylphenyl)-2-(4-propan-2-yloxyanilino)acetamide
CID 54822316
N-(1-methoxypropan-2-yl)-2-[(2-methylpropan-2-yl)oxyamino]acetamide
CID 82723999
2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-N-(1-methoxypropan-2-yl)acetamide
CID 60684179
N-pentan-2-yl-2-(4-propoxyanilino)acetamide
CID 62328507

Frequently Asked Questions

What is the IUPAC name of N-(1-methoxypropan-2-yl)-2-(4-propan-2-yloxyanilino)acetamide?
The IUPAC name of N-(1-methoxypropan-2-yl)-2-(4-propan-2-yloxyanilino)acetamide (CID 61487924) is N-(1-methoxypropan-2-yl)-2-(4-propan-2-yloxyanilino)acetamide.
What is the SMILES notation for N-(1-methoxypropan-2-yl)-2-(4-propan-2-yloxyanilino)acetamide?
The canonical SMILES for N-(1-methoxypropan-2-yl)-2-(4-propan-2-yloxyanilino)acetamide is COCC(C)NC(=O)CNc1ccc(OC(C)C)cc1.
What is the InChIKey of N-(1-methoxypropan-2-yl)-2-(4-propan-2-yloxyanilino)acetamide?
The InChIKey is IHNXMPZLFSLLFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O3/c1-11(2)20-14-7-5-13(6-8-14)16-9-15(18)17-12(3)10-19-4/h5-8,11-12,16H,9-10H2,1-4H3,(H,17,18).
What are the key properties of N-(1-methoxypropan-2-yl)-2-(4-propan-2-yloxyanilino)acetamide?
N-(1-methoxypropan-2-yl)-2-(4-propan-2-yloxyanilino)acetamide has a molecular weight of 280.37 g/mol, XLogP of 2.04, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methoxypropan-2-yl)-2-(4-propan-2-yloxyanilino)acetamide is sourced from PubChem (CID 61487924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).