N-(4-methyl-2,3-dihydrochromen-4-yl)-5-propan-2-yl-1,3-oxazole-4-carboxamide

C17H20N2O3 — CID 146141556

IUPACN-(4-methyl-2,3-dihydrochromen-4-yl)-5-propan-2-yl-1,3-oxazole-4-carboxamide
SMILESCC(C)c1ocnc1C(=O)NC1(C)CCOc2ccccc21
InChIInChI=1S/C17H20N2O3/c1-11(2)15-14(18-10-22-15)16(20)19-17(3)8-9-21-13-7-5-4-6-12(13)17/h4-7,10-11H,8-9H2,1-3H3,(H,19,20)
InChIKeyYWWUVVBOGSMEOV-UHFFFAOYSA-N
MW300.36 g/mol
LogP3.23
Rot. Bonds3

About N-(4-methyl-2,3-dihydrochromen-4-yl)-5-propan-2-yl-1,3-oxazole-4-carboxamide

N-(4-methyl-2,3-dihydrochromen-4-yl)-5-propan-2-yl-1,3-oxazole-4-carboxamide (PubChem CID 146141556) has the molecular formula C17H20N2O3 and a molecular weight of 300.36 g/mol. Its IUPAC name is N-(4-methyl-2,3-dihydrochromen-4-yl)-5-propan-2-yl-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound NameN-(4-methyl-2,3-dihydrochromen-4-yl)-5-propan-2-yl-1,3-oxazole-4-carboxamide
PubChem CID146141556
Molecular FormulaC17H20N2O3
Molecular Weight300.36 g/mol
Exact Mass300.15
IUPAC NameN-(4-methyl-2,3-dihydrochromen-4-yl)-5-propan-2-yl-1,3-oxazole-4-carboxamide
SMILESCC(C)c1ocnc1C(=O)NC1(C)CCOc2ccccc21
InChIInChI=1S/C17H20N2O3/c1-11(2)15-14(18-10-22-15)16(20)19-17(3)8-9-21-13-7-5-4-6-12(13)17/h4-7,10-11H,8-9H2,1-3H3,(H,19,20)
InChIKeyYWWUVVBOGSMEOV-UHFFFAOYSA-N
XLogP3.23
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(4-methyl-2,3-dihydrochromen-4-yl)-5-propan-2-yl-1,3-oxazole-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-2,3-dihydrochromen-4-yl)-5-propan-2-yl-1,3-oxazole-4-carboxamide?
The IUPAC name of N-(4-methyl-2,3-dihydrochromen-4-yl)-5-propan-2-yl-1,3-oxazole-4-carboxamide (CID 146141556) is N-(4-methyl-2,3-dihydrochromen-4-yl)-5-propan-2-yl-1,3-oxazole-4-carboxamide.
What is the SMILES notation for N-(4-methyl-2,3-dihydrochromen-4-yl)-5-propan-2-yl-1,3-oxazole-4-carboxamide?
The canonical SMILES for N-(4-methyl-2,3-dihydrochromen-4-yl)-5-propan-2-yl-1,3-oxazole-4-carboxamide is CC(C)c1ocnc1C(=O)NC1(C)CCOc2ccccc21.
What is the InChIKey of N-(4-methyl-2,3-dihydrochromen-4-yl)-5-propan-2-yl-1,3-oxazole-4-carboxamide?
The InChIKey is YWWUVVBOGSMEOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O3/c1-11(2)15-14(18-10-22-15)16(20)19-17(3)8-9-21-13-7-5-4-6-12(13)17/h4-7,10-11H,8-9H2,1-3H3,(H,19,20).
What are the key properties of N-(4-methyl-2,3-dihydrochromen-4-yl)-5-propan-2-yl-1,3-oxazole-4-carboxamide?
N-(4-methyl-2,3-dihydrochromen-4-yl)-5-propan-2-yl-1,3-oxazole-4-carboxamide has a molecular weight of 300.36 g/mol, XLogP of 3.23, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-2,3-dihydrochromen-4-yl)-5-propan-2-yl-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 146141556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).