N-(2,3-dihydro-1H-inden-1-yl)-N-methyl-1,3-oxazole-4-carboxamide

C14H14N2O2 — CID 138997641

IUPACN-(2,3-dihydro-1H-inden-1-yl)-N-methyl-1,3-oxazole-4-carboxamide
SMILESCN(C(=O)c1cocn1)C1CCc2ccccc21
InChIInChI=1S/C14H14N2O2/c1-16(14(17)12-8-18-9-15-12)13-7-6-10-4-2-3-5-11(10)13/h2-5,8-9,13H,6-7H2,1H3
InChIKeyDSQZFIBQKKEWMJ-UHFFFAOYSA-N
MW242.28 g/mol
LogP2.43
Rot. Bonds2

About N-(2,3-dihydro-1H-inden-1-yl)-N-methyl-1,3-oxazole-4-carboxamide

N-(2,3-dihydro-1H-inden-1-yl)-N-methyl-1,3-oxazole-4-carboxamide (PubChem CID 138997641) has the molecular formula C14H14N2O2 and a molecular weight of 242.28 g/mol. Its IUPAC name is N-(2,3-dihydro-1H-inden-1-yl)-N-methyl-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound NameN-(2,3-dihydro-1H-inden-1-yl)-N-methyl-1,3-oxazole-4-carboxamide
PubChem CID138997641
Molecular FormulaC14H14N2O2
Molecular Weight242.28 g/mol
Exact Mass242.11
IUPAC NameN-(2,3-dihydro-1H-inden-1-yl)-N-methyl-1,3-oxazole-4-carboxamide
SMILESCN(C(=O)c1cocn1)C1CCc2ccccc21
InChIInChI=1S/C14H14N2O2/c1-16(14(17)12-8-18-9-15-12)13-7-6-10-4-2-3-5-11(10)13/h2-5,8-9,13H,6-7H2,1H3
InChIKeyDSQZFIBQKKEWMJ-UHFFFAOYSA-N
XLogP2.43
TPSA46.34 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.28
LogP ≤ 52.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,3-dihydro-1H-inden-1-yl)-N-methylpyrazine-2-carboxamide
CID 42941214
N-(2,3-dihydro-1H-inden-1-yl)-N,6-dimethylpyridine-2-carboxamide
CID 42944559
N-(2,3-dihydro-1H-inden-1-yl)-2-fluoro-N-methylpyridine-3-carboxamide
CID 107358584
N-[(1R)-2,3-dihydro-1H-inden-1-yl]-2-[1-(2-iodoacetyl)piperidin-4-yl]-N-methyl-1,3-oxazole-4-carboxamide
CID 154554774
4-amino-N-(2,3-dihydro-1H-inden-1-yl)-N-methylbenzamide
CID 43575493
N-[(1S)-2,3-dihydro-1H-inden-1-yl]-N-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 39977135
N-(2,3-dihydro-1H-inden-1-yl)-N-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 42946251
N-(2,3-dihydro-1H-inden-1-yl)-N-methylbut-2-enamide
CID 112725238
5-chloro-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazine-2-carboxamide
CID 107371805
N-(2,3-dihydro-1H-inden-1-yl)-4-methoxy-N-methylbenzamide
CID 18283889
N-[(1S)-2,3-dihydro-1H-inden-1-yl]-N-methyl-1-oxo-2H-isoquinoline-4-carboxamide
CID 99790409
N-[(1R)-2,3-dihydro-1H-inden-1-yl]-N,2,4-trimethyl-1,3-thiazole-5-carboxamide
CID 35205344

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1H-inden-1-yl)-N-methyl-1,3-oxazole-4-carboxamide?
The IUPAC name of N-(2,3-dihydro-1H-inden-1-yl)-N-methyl-1,3-oxazole-4-carboxamide (CID 138997641) is N-(2,3-dihydro-1H-inden-1-yl)-N-methyl-1,3-oxazole-4-carboxamide.
What is the SMILES notation for N-(2,3-dihydro-1H-inden-1-yl)-N-methyl-1,3-oxazole-4-carboxamide?
The canonical SMILES for N-(2,3-dihydro-1H-inden-1-yl)-N-methyl-1,3-oxazole-4-carboxamide is CN(C(=O)c1cocn1)C1CCc2ccccc21.
What is the InChIKey of N-(2,3-dihydro-1H-inden-1-yl)-N-methyl-1,3-oxazole-4-carboxamide?
The InChIKey is DSQZFIBQKKEWMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O2/c1-16(14(17)12-8-18-9-15-12)13-7-6-10-4-2-3-5-11(10)13/h2-5,8-9,13H,6-7H2,1H3.
What are the key properties of N-(2,3-dihydro-1H-inden-1-yl)-N-methyl-1,3-oxazole-4-carboxamide?
N-(2,3-dihydro-1H-inden-1-yl)-N-methyl-1,3-oxazole-4-carboxamide has a molecular weight of 242.28 g/mol, XLogP of 2.43, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1H-inden-1-yl)-N-methyl-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 138997641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).