N-[(3-methyl-1,2-oxazol-5-yl)methyl]-2,3-dihydroindole-1-carboxamide

C14H15N3O2 — CID 49110742

IUPACN-[(3-methyl-1,2-oxazol-5-yl)methyl]-2,3-dihydroindole-1-carboxamide
SMILESCc1cc(CNC(=O)N2CCc3ccccc32)on1
InChIInChI=1S/C14H15N3O2/c1-10-8-12(19-16-10)9-15-14(18)17-7-6-11-4-2-3-5-13(11)17/h2-5,8H,6-7,9H2,1H3,(H,15,18)
InChIKeyCVNGGFBWONFIHR-UHFFFAOYSA-N
MW257.29 g/mol
LogP2.26
Rot. Bonds2

About N-[(3-methyl-1,2-oxazol-5-yl)methyl]-2,3-dihydroindole-1-carboxamide

N-[(3-methyl-1,2-oxazol-5-yl)methyl]-2,3-dihydroindole-1-carboxamide (PubChem CID 49110742) has the molecular formula C14H15N3O2 and a molecular weight of 257.29 g/mol. Its IUPAC name is N-[(3-methyl-1,2-oxazol-5-yl)methyl]-2,3-dihydroindole-1-carboxamide.

Molecular Properties

Compound NameN-[(3-methyl-1,2-oxazol-5-yl)methyl]-2,3-dihydroindole-1-carboxamide
PubChem CID49110742
Molecular FormulaC14H15N3O2
Molecular Weight257.29 g/mol
Exact Mass257.12
IUPAC NameN-[(3-methyl-1,2-oxazol-5-yl)methyl]-2,3-dihydroindole-1-carboxamide
SMILESCc1cc(CNC(=O)N2CCc3ccccc32)on1
InChIInChI=1S/C14H15N3O2/c1-10-8-12(19-16-10)9-15-14(18)17-7-6-11-4-2-3-5-13(11)17/h2-5,8H,6-7,9H2,1H3,(H,15,18)
InChIKeyCVNGGFBWONFIHR-UHFFFAOYSA-N
XLogP2.26
TPSA58.37 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(3-methyl-1,2-oxazol-5-yl)methyl]-2,3-dihydroindole-1-carboxamide?
The IUPAC name of N-[(3-methyl-1,2-oxazol-5-yl)methyl]-2,3-dihydroindole-1-carboxamide (CID 49110742) is N-[(3-methyl-1,2-oxazol-5-yl)methyl]-2,3-dihydroindole-1-carboxamide.
What is the SMILES notation for N-[(3-methyl-1,2-oxazol-5-yl)methyl]-2,3-dihydroindole-1-carboxamide?
The canonical SMILES for N-[(3-methyl-1,2-oxazol-5-yl)methyl]-2,3-dihydroindole-1-carboxamide is Cc1cc(CNC(=O)N2CCc3ccccc32)on1.
What is the InChIKey of N-[(3-methyl-1,2-oxazol-5-yl)methyl]-2,3-dihydroindole-1-carboxamide?
The InChIKey is CVNGGFBWONFIHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O2/c1-10-8-12(19-16-10)9-15-14(18)17-7-6-11-4-2-3-5-13(11)17/h2-5,8H,6-7,9H2,1H3,(H,15,18).
What are the key properties of N-[(3-methyl-1,2-oxazol-5-yl)methyl]-2,3-dihydroindole-1-carboxamide?
N-[(3-methyl-1,2-oxazol-5-yl)methyl]-2,3-dihydroindole-1-carboxamide has a molecular weight of 257.29 g/mol, XLogP of 2.26, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-methyl-1,2-oxazol-5-yl)methyl]-2,3-dihydroindole-1-carboxamide is sourced from PubChem (CID 49110742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).