N-[2-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]phenyl]-2-oxoimidazolidine-1-carboxamide

C16H17N5O3 — CID 72717387

IUPACN-[2-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]phenyl]-2-oxoimidazolidine-1-carboxamide
SMILESO=C1NCCN1C(=O)Nc1ccccc1Cc1nc(C2CC2)no1
InChIInChI=1S/C16H17N5O3/c22-15-17-7-8-21(15)16(23)18-12-4-2-1-3-11(12)9-13-19-14(20-24-13)10-5-6-10/h1-4,10H,5-9H2,(H,17,22)(H,18,23)
InChIKeyGEYABERFMMDUTO-UHFFFAOYSA-N
MW327.34 g/mol
LogP2.09
Rot. Bonds4

About N-[2-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]phenyl]-2-oxoimidazolidine-1-carboxamide

N-[2-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]phenyl]-2-oxoimidazolidine-1-carboxamide (PubChem CID 72717387) has the molecular formula C16H17N5O3 and a molecular weight of 327.34 g/mol. Its IUPAC name is N-[2-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]phenyl]-2-oxoimidazolidine-1-carboxamide.

Molecular Properties

Compound NameN-[2-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]phenyl]-2-oxoimidazolidine-1-carboxamide
PubChem CID72717387
Molecular FormulaC16H17N5O3
Molecular Weight327.34 g/mol
Exact Mass327.13
IUPAC NameN-[2-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]phenyl]-2-oxoimidazolidine-1-carboxamide
SMILESO=C1NCCN1C(=O)Nc1ccccc1Cc1nc(C2CC2)no1
InChIInChI=1S/C16H17N5O3/c22-15-17-7-8-21(15)16(23)18-12-4-2-1-3-11(12)9-13-19-14(20-24-13)10-5-6-10/h1-4,10H,5-9H2,(H,17,22)(H,18,23)
InChIKeyGEYABERFMMDUTO-UHFFFAOYSA-N
XLogP2.09
TPSA100.36 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.34
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[2-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]phenyl]-2-oxoimidazolidine-1-carboxamide?
The IUPAC name of N-[2-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]phenyl]-2-oxoimidazolidine-1-carboxamide (CID 72717387) is N-[2-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]phenyl]-2-oxoimidazolidine-1-carboxamide.
What is the SMILES notation for N-[2-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]phenyl]-2-oxoimidazolidine-1-carboxamide?
The canonical SMILES for N-[2-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]phenyl]-2-oxoimidazolidine-1-carboxamide is O=C1NCCN1C(=O)Nc1ccccc1Cc1nc(C2CC2)no1.
What is the InChIKey of N-[2-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]phenyl]-2-oxoimidazolidine-1-carboxamide?
The InChIKey is GEYABERFMMDUTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N5O3/c22-15-17-7-8-21(15)16(23)18-12-4-2-1-3-11(12)9-13-19-14(20-24-13)10-5-6-10/h1-4,10H,5-9H2,(H,17,22)(H,18,23).
What are the key properties of N-[2-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]phenyl]-2-oxoimidazolidine-1-carboxamide?
N-[2-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]phenyl]-2-oxoimidazolidine-1-carboxamide has a molecular weight of 327.34 g/mol, XLogP of 2.09, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]phenyl]-2-oxoimidazolidine-1-carboxamide is sourced from PubChem (CID 72717387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).