N-(4-acetamidophenyl)-2-amino-2-cyclopropylpropanamide

C14H19N3O2 — CID 60866095

IUPACN-(4-acetamidophenyl)-2-amino-2-cyclopropylpropanamide
SMILESCC(=O)Nc1ccc(NC(=O)C(C)(N)C2CC2)cc1
InChIInChI=1S/C14H19N3O2/c1-9(18)16-11-5-7-12(8-6-11)17-13(19)14(2,15)10-3-4-10/h5-8,10H,3-4,15H2,1-2H3,(H,16,18)(H,17,19)
InChIKeyWCIXZKLOMNZAIW-UHFFFAOYSA-N
MW261.32 g/mol
LogP1.71
Rot. Bonds4

About N-(4-acetamidophenyl)-2-amino-2-cyclopropylpropanamide

N-(4-acetamidophenyl)-2-amino-2-cyclopropylpropanamide (PubChem CID 60866095) has the molecular formula C14H19N3O2 and a molecular weight of 261.32 g/mol. Its IUPAC name is N-(4-acetamidophenyl)-2-amino-2-cyclopropylpropanamide.

Molecular Properties

Compound NameN-(4-acetamidophenyl)-2-amino-2-cyclopropylpropanamide
PubChem CID60866095
Molecular FormulaC14H19N3O2
Molecular Weight261.32 g/mol
Exact Mass261.15
IUPAC NameN-(4-acetamidophenyl)-2-amino-2-cyclopropylpropanamide
SMILESCC(=O)Nc1ccc(NC(=O)C(C)(N)C2CC2)cc1
InChIInChI=1S/C14H19N3O2/c1-9(18)16-11-5-7-12(8-6-11)17-13(19)14(2,15)10-3-4-10/h5-8,10H,3-4,15H2,1-2H3,(H,16,18)(H,17,19)
InChIKeyWCIXZKLOMNZAIW-UHFFFAOYSA-N
XLogP1.71
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 51.71
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-[(2-amino-2-cyclopropylpropanoyl)amino]phenyl]cyclopropanecarboxamide
CID 61252070
2-amino-2-cyclopropyl-N-(4-propan-2-ylphenyl)propanamide
CID 60866090
2-amino-2-cyclopropyl-N-(4-methoxyphenyl)propanamide
CID 54925277
2-amino-2-cyclopropyl-N-[4-(2-hydroxyethyl)phenyl]propanamide
CID 61237343
2-amino-2-cyclopropyl-N-[4-(sulfamoylmethyl)phenyl]propanamide
CID 60867551
2-amino-2-cyclopropyl-N-[4-(triazol-2-yl)phenyl]propanamide
CID 60867892
2-amino-2-cyclopropyl-N-(3-hydroxy-4-methylphenyl)propanamide
CID 107701447
2-amino-2-cyclopropyl-N-(4-fluoro-3-methylphenyl)propanamide
CID 55118792
2-amino-N-(6-bromo-3-pyridinyl)-2-cyclopropylpropanamide
CID 103821261
2-amino-2-cyclopropyl-N-[4-[ethyl(2-hydroxyethyl)amino]phenyl]propanamide
CID 60945791
2-amino-2-cyclopropyl-N-[3-(dimethylamino)-4-methylphenyl]propanamide
CID 115377371
2-amino-2-cyclopropyl-N-[4-(2-oxo-1H-imidazol-3-yl)phenyl]propanamide
CID 60928039

Frequently Asked Questions

What is the IUPAC name of N-(4-acetamidophenyl)-2-amino-2-cyclopropylpropanamide?
The IUPAC name of N-(4-acetamidophenyl)-2-amino-2-cyclopropylpropanamide (CID 60866095) is N-(4-acetamidophenyl)-2-amino-2-cyclopropylpropanamide.
What is the SMILES notation for N-(4-acetamidophenyl)-2-amino-2-cyclopropylpropanamide?
The canonical SMILES for N-(4-acetamidophenyl)-2-amino-2-cyclopropylpropanamide is CC(=O)Nc1ccc(NC(=O)C(C)(N)C2CC2)cc1.
What is the InChIKey of N-(4-acetamidophenyl)-2-amino-2-cyclopropylpropanamide?
The InChIKey is WCIXZKLOMNZAIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2/c1-9(18)16-11-5-7-12(8-6-11)17-13(19)14(2,15)10-3-4-10/h5-8,10H,3-4,15H2,1-2H3,(H,16,18)(H,17,19).
What are the key properties of N-(4-acetamidophenyl)-2-amino-2-cyclopropylpropanamide?
N-(4-acetamidophenyl)-2-amino-2-cyclopropylpropanamide has a molecular weight of 261.32 g/mol, XLogP of 1.71, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamidophenyl)-2-amino-2-cyclopropylpropanamide is sourced from PubChem (CID 60866095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).