6-amino-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1H-indole-3-carboxamide

C15H16N4O2 — CID 106387438

IUPAC6-amino-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1H-indole-3-carboxamide
SMILESCc1cnc(C(C)NC(=O)c2c[nH]c3cc(N)ccc23)o1
InChIInChI=1S/C15H16N4O2/c1-8-6-18-15(21-8)9(2)19-14(20)12-7-17-13-5-10(16)3-4-11(12)13/h3-7,9,17H,16H2,1-2H3,(H,19,20)
InChIKeyMWQVAYBUELOEAP-UHFFFAOYSA-N
MW284.32 g/mol
LogP2.54
Rot. Bonds3

About 6-amino-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1H-indole-3-carboxamide

6-amino-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1H-indole-3-carboxamide (PubChem CID 106387438) has the molecular formula C15H16N4O2 and a molecular weight of 284.32 g/mol. Its IUPAC name is 6-amino-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1H-indole-3-carboxamide.

Molecular Properties

Compound Name6-amino-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1H-indole-3-carboxamide
PubChem CID106387438
Molecular FormulaC15H16N4O2
Molecular Weight284.32 g/mol
Exact Mass284.13
IUPAC Name6-amino-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1H-indole-3-carboxamide
SMILESCc1cnc(C(C)NC(=O)c2c[nH]c3cc(N)ccc23)o1
InChIInChI=1S/C15H16N4O2/c1-8-6-18-15(21-8)9(2)19-14(20)12-7-17-13-5-10(16)3-4-11(12)13/h3-7,9,17H,16H2,1-2H3,(H,19,20)
InChIKeyMWQVAYBUELOEAP-UHFFFAOYSA-N
XLogP2.54
TPSA96.94 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.32
LogP ≤ 52.54
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-amino-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1H-indole-3-carboxamide?
The IUPAC name of 6-amino-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1H-indole-3-carboxamide (CID 106387438) is 6-amino-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1H-indole-3-carboxamide.
What is the SMILES notation for 6-amino-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1H-indole-3-carboxamide?
The canonical SMILES for 6-amino-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1H-indole-3-carboxamide is Cc1cnc(C(C)NC(=O)c2c[nH]c3cc(N)ccc23)o1.
What is the InChIKey of 6-amino-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1H-indole-3-carboxamide?
The InChIKey is MWQVAYBUELOEAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O2/c1-8-6-18-15(21-8)9(2)19-14(20)12-7-17-13-5-10(16)3-4-11(12)13/h3-7,9,17H,16H2,1-2H3,(H,19,20).
What are the key properties of 6-amino-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1H-indole-3-carboxamide?
6-amino-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1H-indole-3-carboxamide has a molecular weight of 284.32 g/mol, XLogP of 2.54, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1H-indole-3-carboxamide is sourced from PubChem (CID 106387438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).