N-(3-acetamidophenyl)-2-aminopropanamide

C11H15N3O2 — CID 24711020

IUPACN-(3-acetamidophenyl)-2-aminopropanamide
SMILESCC(=O)Nc1cccc(NC(=O)C(C)N)c1
InChIInChI=1S/C11H15N3O2/c1-7(12)11(16)14-10-5-3-4-9(6-10)13-8(2)15/h3-7H,12H2,1-2H3,(H,13,15)(H,14,16)
InChIKeyGNXTXCCUWLPMFA-UHFFFAOYSA-N
MW221.26 g/mol
LogP0.93
Rot. Bonds3

About N-(3-acetamidophenyl)-2-aminopropanamide

N-(3-acetamidophenyl)-2-aminopropanamide (PubChem CID 24711020) has the molecular formula C11H15N3O2 and a molecular weight of 221.26 g/mol. Its IUPAC name is N-(3-acetamidophenyl)-2-aminopropanamide.

Molecular Properties

Compound NameN-(3-acetamidophenyl)-2-aminopropanamide
PubChem CID24711020
Molecular FormulaC11H15N3O2
Molecular Weight221.26 g/mol
Exact Mass221.12
IUPAC NameN-(3-acetamidophenyl)-2-aminopropanamide
SMILESCC(=O)Nc1cccc(NC(=O)C(C)N)c1
InChIInChI=1S/C11H15N3O2/c1-7(12)11(16)14-10-5-3-4-9(6-10)13-8(2)15/h3-7H,12H2,1-2H3,(H,13,15)(H,14,16)
InChIKeyGNXTXCCUWLPMFA-UHFFFAOYSA-N
XLogP0.93
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 50.93
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-[[(2R)-2-aminopropanoyl]amino]phenyl]-2-methylpropanamide;hydrochloride
CID 119281775
(2S)-2-amino-N-[3-(2-methoxypropanoylamino)phenyl]propanamide;hydrochloride
CID 119305153
2-amino-N-(3-aminophenyl)propanamide
CID 110478892
N-(4-acetamidophenyl)-2-aminopropanamide;hydrochloride
CID 119261426
(2S)-2-amino-N-(3-iodophenyl)propanamide
CID 28882940
3-(2-aminopropanoylamino)benzamide
CID 61258270
N-(3-acetamidophenyl)-2-amino-3,3-dimethylbutanamide
CID 76891982
N-[1-(3-acetamidophenyl)ethyl]-2-aminopropanamide
CID 54880242
2-amino-N-(3-methylsulfinylphenyl)propanamide;hydrochloride
CID 119300630
N-[3-[[(2S)-2-aminopropanoyl]amino]phenyl]cyclopropanecarboxamide
CID 78968942
(2R)-2-amino-N-phenylpropanamide
CID 10607114
2-amino-N-[3-(aminomethyl)phenyl]propanamide
CID 62070130

Frequently Asked Questions

What is the IUPAC name of N-(3-acetamidophenyl)-2-aminopropanamide?
The IUPAC name of N-(3-acetamidophenyl)-2-aminopropanamide (CID 24711020) is N-(3-acetamidophenyl)-2-aminopropanamide.
What is the SMILES notation for N-(3-acetamidophenyl)-2-aminopropanamide?
The canonical SMILES for N-(3-acetamidophenyl)-2-aminopropanamide is CC(=O)Nc1cccc(NC(=O)C(C)N)c1.
What is the InChIKey of N-(3-acetamidophenyl)-2-aminopropanamide?
The InChIKey is GNXTXCCUWLPMFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O2/c1-7(12)11(16)14-10-5-3-4-9(6-10)13-8(2)15/h3-7H,12H2,1-2H3,(H,13,15)(H,14,16).
What are the key properties of N-(3-acetamidophenyl)-2-aminopropanamide?
N-(3-acetamidophenyl)-2-aminopropanamide has a molecular weight of 221.26 g/mol, XLogP of 0.93, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetamidophenyl)-2-aminopropanamide is sourced from PubChem (CID 24711020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).