3-(3,4-dihydro-2H-chromen-5-yl)propanamide

C12H15NO2 — CID 19611662

IUPAC3-(3,4-dihydro-2H-chromen-5-yl)propanamide
SMILESNC(=O)CCc1cccc2c1CCCO2
InChIInChI=1S/C12H15NO2/c13-12(14)7-6-9-3-1-5-11-10(9)4-2-8-15-11/h1,3,5H,2,4,6-8H2,(H2,13,14)
InChIKeyKXOFUDZZBQFUKX-UHFFFAOYSA-N
MW205.26 g/mol
LogP1.43
Rot. Bonds3

About 3-(3,4-dihydro-2H-chromen-5-yl)propanamide

3-(3,4-dihydro-2H-chromen-5-yl)propanamide (PubChem CID 19611662) has the molecular formula C12H15NO2 and a molecular weight of 205.26 g/mol. Its IUPAC name is 3-(3,4-dihydro-2H-chromen-5-yl)propanamide.

Molecular Properties

Compound Name3-(3,4-dihydro-2H-chromen-5-yl)propanamide
PubChem CID19611662
Molecular FormulaC12H15NO2
Molecular Weight205.26 g/mol
Exact Mass205.11
IUPAC Name3-(3,4-dihydro-2H-chromen-5-yl)propanamide
SMILESNC(=O)CCc1cccc2c1CCCO2
InChIInChI=1S/C12H15NO2/c13-12(14)7-6-9-3-1-5-11-10(9)4-2-8-15-11/h1,3,5H,2,4,6-8H2,(H2,13,14)
InChIKeyKXOFUDZZBQFUKX-UHFFFAOYSA-N
XLogP1.43
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-(3,4-dihydro-2H-chromen-5-yl)propanamide 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

4-(2,3-dihydro-1-benzofuran-4-yl)butan-1-amine
CID 117282588
3-(1,2,3,4-tetrahydroisoquinolin-5-yl)propanamide
CID 115105046
5-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethylamino)pentanamide
CID 106234592
(2S)-4-(2,3-dihydro-1-benzofuran-4-yl)butan-2-amine
CID 130612679
(2R)-2-amino-2-(3,4-dihydro-2H-chromen-5-yl)ethanol
CID 131142085
5-bromo-3,4-dihydro-2H-chromene
CID 22009964
2,2,2-trifluoroethyl 2-[3,4-dihydro-2H-chromen-5-ylmethyl(pyridin-2-ylmethyl)amino]-2-oxoacetate
CID 169111939
4-(bromomethyl)-2,3-dihydro-1-benzofuran
CID 139534248
1-(2,3-dihydro-1-benzofuran-4-ylmethyl)cyclopropan-1-amine
CID 117281579
2-[2-(2,3-dihydro-1-benzofuran-4-yl)cyclopropyl]acetamide
CID 123181605
sodium;hydride;3-(2-hydroxyphenyl)propanamide
CID 174978881
1-(2,3-dihydro-1-benzofuran-4-yl)-N,N-dimethylmethanamine
CID 141164132

Frequently Asked Questions

What is the IUPAC name of 3-(3,4-dihydro-2H-chromen-5-yl)propanamide?
The IUPAC name of 3-(3,4-dihydro-2H-chromen-5-yl)propanamide (CID 19611662) is 3-(3,4-dihydro-2H-chromen-5-yl)propanamide.
What is the SMILES notation for 3-(3,4-dihydro-2H-chromen-5-yl)propanamide?
The canonical SMILES for 3-(3,4-dihydro-2H-chromen-5-yl)propanamide is NC(=O)CCc1cccc2c1CCCO2.
What is the InChIKey of 3-(3,4-dihydro-2H-chromen-5-yl)propanamide?
The InChIKey is KXOFUDZZBQFUKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO2/c13-12(14)7-6-9-3-1-5-11-10(9)4-2-8-15-11/h1,3,5H,2,4,6-8H2,(H2,13,14).
What are the key properties of 3-(3,4-dihydro-2H-chromen-5-yl)propanamide?
3-(3,4-dihydro-2H-chromen-5-yl)propanamide has a molecular weight of 205.26 g/mol, XLogP of 1.43, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,4-dihydro-2H-chromen-5-yl)propanamide is sourced from PubChem (CID 19611662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).