2-amino-2-cyclopropyl-N-(4-methoxyphenyl)propanamide

C13H18N2O2 — CID 54925277

IUPAC2-amino-2-cyclopropyl-N-(4-methoxyphenyl)propanamide
SMILESCOc1ccc(NC(=O)C(C)(N)C2CC2)cc1
InChIInChI=1S/C13H18N2O2/c1-13(14,9-3-4-9)12(16)15-10-5-7-11(17-2)8-6-10/h5-9H,3-4,14H2,1-2H3,(H,15,16)
InChIKeyULENBRSELYPVLG-UHFFFAOYSA-N
MW234.30 g/mol
LogP1.76
Rot. Bonds4

About 2-amino-2-cyclopropyl-N-(4-methoxyphenyl)propanamide

2-amino-2-cyclopropyl-N-(4-methoxyphenyl)propanamide (PubChem CID 54925277) has the molecular formula C13H18N2O2 and a molecular weight of 234.30 g/mol. Its IUPAC name is 2-amino-2-cyclopropyl-N-(4-methoxyphenyl)propanamide.

Molecular Properties

Compound Name2-amino-2-cyclopropyl-N-(4-methoxyphenyl)propanamide
PubChem CID54925277
Molecular FormulaC13H18N2O2
Molecular Weight234.30 g/mol
Exact Mass234.14
IUPAC Name2-amino-2-cyclopropyl-N-(4-methoxyphenyl)propanamide
SMILESCOc1ccc(NC(=O)C(C)(N)C2CC2)cc1
InChIInChI=1S/C13H18N2O2/c1-13(14,9-3-4-9)12(16)15-10-5-7-11(17-2)8-6-10/h5-9H,3-4,14H2,1-2H3,(H,15,16)
InChIKeyULENBRSELYPVLG-UHFFFAOYSA-N
XLogP1.76
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-acetamidophenyl)-2-amino-2-cyclopropylpropanamide
CID 60866095
N-[4-[(2-amino-2-cyclopropylpropanoyl)amino]phenyl]cyclopropanecarboxamide
CID 61252070
2-amino-N-(4-methoxyphenyl)-2-methylpropanamide;hydrochloride
CID 56832266
2-amino-2-cyclopropyl-N-(4-propan-2-ylphenyl)propanamide
CID 60866090
N-cyclopropyl-N'-(4-methoxyphenyl)-2,2-dimethylpropanediamide
CID 108957499
2-amino-2-cyclopropyl-N-[4-(2-hydroxyethyl)phenyl]propanamide
CID 61237343
2-amino-3,3,3-trifluoro-N-(4-methoxyphenyl)-2-methylpropanamide
CID 79788488
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-N-(4-methoxyphenyl)-2-phenylpropanamide
CID 62487859
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

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-cyclopropyl-N-(4-methoxyphenyl)propanamide?
The IUPAC name of 2-amino-2-cyclopropyl-N-(4-methoxyphenyl)propanamide (CID 54925277) is 2-amino-2-cyclopropyl-N-(4-methoxyphenyl)propanamide.
What is the SMILES notation for 2-amino-2-cyclopropyl-N-(4-methoxyphenyl)propanamide?
The canonical SMILES for 2-amino-2-cyclopropyl-N-(4-methoxyphenyl)propanamide is COc1ccc(NC(=O)C(C)(N)C2CC2)cc1.
What is the InChIKey of 2-amino-2-cyclopropyl-N-(4-methoxyphenyl)propanamide?
The InChIKey is ULENBRSELYPVLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O2/c1-13(14,9-3-4-9)12(16)15-10-5-7-11(17-2)8-6-10/h5-9H,3-4,14H2,1-2H3,(H,15,16).
What are the key properties of 2-amino-2-cyclopropyl-N-(4-methoxyphenyl)propanamide?
2-amino-2-cyclopropyl-N-(4-methoxyphenyl)propanamide has a molecular weight of 234.30 g/mol, XLogP of 1.76, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-cyclopropyl-N-(4-methoxyphenyl)propanamide is sourced from PubChem (CID 54925277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).