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

C14H15N3O2 — CID 76923479

IUPACN-[(5-methyl-1,2-oxazol-3-yl)methyl]-2,3-dihydro-1H-indole-2-carboxamide
SMILESCc1cc(CNC(=O)C2Cc3ccccc3N2)no1
InChIInChI=1S/C14H15N3O2/c1-9-6-11(17-19-9)8-15-14(18)13-7-10-4-2-3-5-12(10)16-13/h2-6,13,16H,7-8H2,1H3,(H,15,18)
InChIKeyQMQWJZFAYYZCBW-UHFFFAOYSA-N
MW257.29 g/mol
LogP1.64
Rot. Bonds3

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

N-[(5-methyl-1,2-oxazol-3-yl)methyl]-2,3-dihydro-1H-indole-2-carboxamide (PubChem CID 76923479) has the molecular formula C14H15N3O2 and a molecular weight of 257.29 g/mol. Its IUPAC name is N-[(5-methyl-1,2-oxazol-3-yl)methyl]-2,3-dihydro-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-[(5-methyl-1,2-oxazol-3-yl)methyl]-2,3-dihydro-1H-indole-2-carboxamide
PubChem CID76923479
Molecular FormulaC14H15N3O2
Molecular Weight257.29 g/mol
Exact Mass257.12
IUPAC NameN-[(5-methyl-1,2-oxazol-3-yl)methyl]-2,3-dihydro-1H-indole-2-carboxamide
SMILESCc1cc(CNC(=O)C2Cc3ccccc3N2)no1
InChIInChI=1S/C14H15N3O2/c1-9-6-11(17-19-9)8-15-14(18)13-7-10-4-2-3-5-12(10)16-13/h2-6,13,16H,7-8H2,1H3,(H,15,18)
InChIKeyQMQWJZFAYYZCBW-UHFFFAOYSA-N
XLogP1.64
TPSA67.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 44398160
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CID 850473
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CID 1246695
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CID 5307399
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CID 5307531
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Frequently Asked Questions

What is the IUPAC name of N-[(5-methyl-1,2-oxazol-3-yl)methyl]-2,3-dihydro-1H-indole-2-carboxamide?
The IUPAC name of N-[(5-methyl-1,2-oxazol-3-yl)methyl]-2,3-dihydro-1H-indole-2-carboxamide (CID 76923479) is N-[(5-methyl-1,2-oxazol-3-yl)methyl]-2,3-dihydro-1H-indole-2-carboxamide.
What is the SMILES notation for N-[(5-methyl-1,2-oxazol-3-yl)methyl]-2,3-dihydro-1H-indole-2-carboxamide?
The canonical SMILES for N-[(5-methyl-1,2-oxazol-3-yl)methyl]-2,3-dihydro-1H-indole-2-carboxamide is Cc1cc(CNC(=O)C2Cc3ccccc3N2)no1.
What is the InChIKey of N-[(5-methyl-1,2-oxazol-3-yl)methyl]-2,3-dihydro-1H-indole-2-carboxamide?
The InChIKey is QMQWJZFAYYZCBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O2/c1-9-6-11(17-19-9)8-15-14(18)13-7-10-4-2-3-5-12(10)16-13/h2-6,13,16H,7-8H2,1H3,(H,15,18).
What are the key properties of N-[(5-methyl-1,2-oxazol-3-yl)methyl]-2,3-dihydro-1H-indole-2-carboxamide?
N-[(5-methyl-1,2-oxazol-3-yl)methyl]-2,3-dihydro-1H-indole-2-carboxamide has a molecular weight of 257.29 g/mol, XLogP of 1.64, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-methyl-1,2-oxazol-3-yl)methyl]-2,3-dihydro-1H-indole-2-carboxamide is sourced from PubChem (CID 76923479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).