N-[2-(3,4-dihydro-2H-chromen-6-yl)-2-methylpropyl]acetamide

C15H21NO2 — CID 115191462

IUPACN-[2-(3,4-dihydro-2H-chromen-6-yl)-2-methylpropyl]acetamide
SMILESCC(=O)NCC(C)(C)c1ccc2c(c1)CCCO2
InChIInChI=1S/C15H21NO2/c1-11(17)16-10-15(2,3)13-6-7-14-12(9-13)5-4-8-18-14/h6-7,9H,4-5,8,10H2,1-3H3,(H,16,17)
InChIKeyOFMOTDUEJBVMIZ-UHFFFAOYSA-N
MW247.34 g/mol
LogP2.43
Rot. Bonds3

About N-[2-(3,4-dihydro-2H-chromen-6-yl)-2-methylpropyl]acetamide

N-[2-(3,4-dihydro-2H-chromen-6-yl)-2-methylpropyl]acetamide (PubChem CID 115191462) has the molecular formula C15H21NO2 and a molecular weight of 247.34 g/mol. Its IUPAC name is N-[2-(3,4-dihydro-2H-chromen-6-yl)-2-methylpropyl]acetamide.

Molecular Properties

Compound NameN-[2-(3,4-dihydro-2H-chromen-6-yl)-2-methylpropyl]acetamide
PubChem CID115191462
Molecular FormulaC15H21NO2
Molecular Weight247.34 g/mol
Exact Mass247.16
IUPAC NameN-[2-(3,4-dihydro-2H-chromen-6-yl)-2-methylpropyl]acetamide
SMILESCC(=O)NCC(C)(C)c1ccc2c(c1)CCCO2
InChIInChI=1S/C15H21NO2/c1-11(17)16-10-15(2,3)13-6-7-14-12(9-13)5-4-8-18-14/h6-7,9H,4-5,8,10H2,1-3H3,(H,16,17)
InChIKeyOFMOTDUEJBVMIZ-UHFFFAOYSA-N
XLogP2.43
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[2-(3,4-dihydro-2H-chromen-6-yl)-2-methylpropyl]acetamide with MolForge

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

Launch Full Analysis

Related Compounds

[[2-(3,4-dihydro-2H-chromen-6-yl)-2-methylpropyl]amino]methanol
CID 115229672
N'-[2-(3,4-dihydro-2H-chromen-6-yl)-2-methylpropyl]-N-methylmethanediamine
CID 115227515
3-(3,4-dihydro-2H-chromen-6-yl)-3-methylbutan-1-ol
CID 79838589
N'-[2-(3,4-dihydro-2H-chromen-6-yl)-2-methylpropyl]ethane-1,2-diamine
CID 115195630
N-tert-butyl-3-(3,4-dihydro-2H-chromen-6-yl)-3-methylbutan-1-amine
CID 79830139
1-N-[2-(2,3-dihydro-1-benzofuran-5-yl)-2-methylpropyl]-2-methylpropane-1,2-diamine
CID 115136364
2-(3,4-dihydro-2H-chromen-6-yl)-N-methylpropan-2-amine
CID 82470188
N-[2-methyl-2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)propyl]acetamide
CID 115191431
3-(3,4-dihydro-2H-chromen-6-yl)-3-methyl-N-(2-methylpropyl)butan-1-amine
CID 79830322
3-(2,3-dihydro-1-benzofuran-5-yl)-3-methylbutan-1-amine
CID 22592399
N-[(2R)-2-hydroxy-2-(5,6,7,8-tetrahydronaphthalen-2-yl)propyl]acetamide
CID 101124562
N-[(2S)-2-hydroxy-2-(5,6,7,8-tetrahydronaphthalen-2-yl)propyl]acetamide
CID 10999367

Frequently Asked Questions

What is the IUPAC name of N-[2-(3,4-dihydro-2H-chromen-6-yl)-2-methylpropyl]acetamide?
The IUPAC name of N-[2-(3,4-dihydro-2H-chromen-6-yl)-2-methylpropyl]acetamide (CID 115191462) is N-[2-(3,4-dihydro-2H-chromen-6-yl)-2-methylpropyl]acetamide.
What is the SMILES notation for N-[2-(3,4-dihydro-2H-chromen-6-yl)-2-methylpropyl]acetamide?
The canonical SMILES for N-[2-(3,4-dihydro-2H-chromen-6-yl)-2-methylpropyl]acetamide is CC(=O)NCC(C)(C)c1ccc2c(c1)CCCO2.
What is the InChIKey of N-[2-(3,4-dihydro-2H-chromen-6-yl)-2-methylpropyl]acetamide?
The InChIKey is OFMOTDUEJBVMIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO2/c1-11(17)16-10-15(2,3)13-6-7-14-12(9-13)5-4-8-18-14/h6-7,9H,4-5,8,10H2,1-3H3,(H,16,17).
What are the key properties of N-[2-(3,4-dihydro-2H-chromen-6-yl)-2-methylpropyl]acetamide?
N-[2-(3,4-dihydro-2H-chromen-6-yl)-2-methylpropyl]acetamide has a molecular weight of 247.34 g/mol, XLogP of 2.43, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3,4-dihydro-2H-chromen-6-yl)-2-methylpropyl]acetamide is sourced from PubChem (CID 115191462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).