2-amino-2-cyclopropyl-N-[4-(2-oxo-1H-imidazol-3-yl)phenyl]propanamide

C15H18N4O2 — CID 60928039

IUPAC2-amino-2-cyclopropyl-N-[4-(2-oxo-1H-imidazol-3-yl)phenyl]propanamide
SMILESCC(N)(C(=O)Nc1ccc(-n2cc[nH]c2=O)cc1)C1CC1
InChIInChI=1S/C15H18N4O2/c1-15(16,10-2-3-10)13(20)18-11-4-6-12(7-5-11)19-9-8-17-14(19)21/h4-10H,2-3,16H2,1H3,(H,17,21)(H,18,20)
InChIKeyBIWORFYLWAAYND-UHFFFAOYSA-N
MW286.34 g/mol
LogP1.23
Rot. Bonds4

About 2-amino-2-cyclopropyl-N-[4-(2-oxo-1H-imidazol-3-yl)phenyl]propanamide

2-amino-2-cyclopropyl-N-[4-(2-oxo-1H-imidazol-3-yl)phenyl]propanamide (PubChem CID 60928039) has the molecular formula C15H18N4O2 and a molecular weight of 286.34 g/mol. Its IUPAC name is 2-amino-2-cyclopropyl-N-[4-(2-oxo-1H-imidazol-3-yl)phenyl]propanamide.

Molecular Properties

Compound Name2-amino-2-cyclopropyl-N-[4-(2-oxo-1H-imidazol-3-yl)phenyl]propanamide
PubChem CID60928039
Molecular FormulaC15H18N4O2
Molecular Weight286.34 g/mol
Exact Mass286.14
IUPAC Name2-amino-2-cyclopropyl-N-[4-(2-oxo-1H-imidazol-3-yl)phenyl]propanamide
SMILESCC(N)(C(=O)Nc1ccc(-n2cc[nH]c2=O)cc1)C1CC1
InChIInChI=1S/C15H18N4O2/c1-15(16,10-2-3-10)13(20)18-11-4-6-12(7-5-11)19-9-8-17-14(19)21/h4-10H,2-3,16H2,1H3,(H,17,21)(H,18,20)
InChIKeyBIWORFYLWAAYND-UHFFFAOYSA-N
XLogP1.23
TPSA92.91 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.34
LogP ≤ 51.23
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-2-cyclopropyl-N-[4-(2-oxo-1H-imidazol-3-yl)phenyl]propanamide?
The IUPAC name of 2-amino-2-cyclopropyl-N-[4-(2-oxo-1H-imidazol-3-yl)phenyl]propanamide (CID 60928039) is 2-amino-2-cyclopropyl-N-[4-(2-oxo-1H-imidazol-3-yl)phenyl]propanamide.
What is the SMILES notation for 2-amino-2-cyclopropyl-N-[4-(2-oxo-1H-imidazol-3-yl)phenyl]propanamide?
The canonical SMILES for 2-amino-2-cyclopropyl-N-[4-(2-oxo-1H-imidazol-3-yl)phenyl]propanamide is CC(N)(C(=O)Nc1ccc(-n2cc[nH]c2=O)cc1)C1CC1.
What is the InChIKey of 2-amino-2-cyclopropyl-N-[4-(2-oxo-1H-imidazol-3-yl)phenyl]propanamide?
The InChIKey is BIWORFYLWAAYND-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O2/c1-15(16,10-2-3-10)13(20)18-11-4-6-12(7-5-11)19-9-8-17-14(19)21/h4-10H,2-3,16H2,1H3,(H,17,21)(H,18,20).
What are the key properties of 2-amino-2-cyclopropyl-N-[4-(2-oxo-1H-imidazol-3-yl)phenyl]propanamide?
2-amino-2-cyclopropyl-N-[4-(2-oxo-1H-imidazol-3-yl)phenyl]propanamide has a molecular weight of 286.34 g/mol, XLogP of 1.23, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-cyclopropyl-N-[4-(2-oxo-1H-imidazol-3-yl)phenyl]propanamide is sourced from PubChem (CID 60928039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).