2-(3-acetamidoanilino)-N-propan-2-ylpropanamide

C14H21N3O2 — CID 43084802

IUPAC2-(3-acetamidoanilino)-N-propan-2-ylpropanamide
SMILESCC(=O)Nc1cccc(NC(C)C(=O)NC(C)C)c1
InChIInChI=1S/C14H21N3O2/c1-9(2)15-14(19)10(3)16-12-6-5-7-13(8-12)17-11(4)18/h5-10,16H,1-4H3,(H,15,19)(H,17,18)
InChIKeyDVWFAXUWUMFUBD-UHFFFAOYSA-N
MW263.34 g/mol
LogP1.97
Rot. Bonds5

About 2-(3-acetamidoanilino)-N-propan-2-ylpropanamide

2-(3-acetamidoanilino)-N-propan-2-ylpropanamide (PubChem CID 43084802) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is 2-(3-acetamidoanilino)-N-propan-2-ylpropanamide.

Molecular Properties

Compound Name2-(3-acetamidoanilino)-N-propan-2-ylpropanamide
PubChem CID43084802
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC Name2-(3-acetamidoanilino)-N-propan-2-ylpropanamide
SMILESCC(=O)Nc1cccc(NC(C)C(=O)NC(C)C)c1
InChIInChI=1S/C14H21N3O2/c1-9(2)15-14(19)10(3)16-12-6-5-7-13(8-12)17-11(4)18/h5-10,16H,1-4H3,(H,15,19)(H,17,18)
InChIKeyDVWFAXUWUMFUBD-UHFFFAOYSA-N
XLogP1.97
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 51.97
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

acetic acid;N-[3-(propan-2-ylamino)phenyl]acetamide
CID 174839462
2-(3-acetamidoanilino)-N-cyclopentylpropanamide
CID 43083456
(2S)-2-(3-acetamidoanilino)-N-cyclohexylpropanamide
CID 40680935
(2S)-2-(3-acetamidoanilino)-N-(2-methylphenyl)propanamide
CID 25354903
N-(3-acetamidophenyl)-2-aminopropanamide
CID 24711020
N-[3-(1-phenylethylamino)phenyl]acetamide
CID 43178472
2-(3-acetamidoanilino)-N-(5-chloro-2-methoxyphenyl)propanamide
CID 17480510
N-[3-(3-methylpentan-2-ylamino)phenyl]acetamide
CID 43201157
N-[1-(3-acetamidophenyl)ethyl]-2-(methylamino)propanamide
CID 62638247
N-[3-[1-(5-methylfuran-2-yl)ethylamino]phenyl]acetamide
CID 43193733
2-(3,5-dimethylanilino)-N-propan-2-ylpropanamide
CID 43084818
N-propan-2-yl-2-(4-propan-2-ylanilino)propanamide
CID 43084814

Frequently Asked Questions

What is the IUPAC name of 2-(3-acetamidoanilino)-N-propan-2-ylpropanamide?
The IUPAC name of 2-(3-acetamidoanilino)-N-propan-2-ylpropanamide (CID 43084802) is 2-(3-acetamidoanilino)-N-propan-2-ylpropanamide.
What is the SMILES notation for 2-(3-acetamidoanilino)-N-propan-2-ylpropanamide?
The canonical SMILES for 2-(3-acetamidoanilino)-N-propan-2-ylpropanamide is CC(=O)Nc1cccc(NC(C)C(=O)NC(C)C)c1.
What is the InChIKey of 2-(3-acetamidoanilino)-N-propan-2-ylpropanamide?
The InChIKey is DVWFAXUWUMFUBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2/c1-9(2)15-14(19)10(3)16-12-6-5-7-13(8-12)17-11(4)18/h5-10,16H,1-4H3,(H,15,19)(H,17,18).
What are the key properties of 2-(3-acetamidoanilino)-N-propan-2-ylpropanamide?
2-(3-acetamidoanilino)-N-propan-2-ylpropanamide has a molecular weight of 263.34 g/mol, XLogP of 1.97, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-acetamidoanilino)-N-propan-2-ylpropanamide is sourced from PubChem (CID 43084802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).