N-[(4-phenyl-3,4-dihydronaphthalen-2-yl)methyl]propanamide

C20H21NO — CID 56926896

IUPACN-[(4-phenyl-3,4-dihydronaphthalen-2-yl)methyl]propanamide
SMILESCCC(=O)NCC1=Cc2ccccc2C(c2ccccc2)C1
InChIInChI=1S/C20H21NO/c1-2-20(22)21-14-15-12-17-10-6-7-11-18(17)19(13-15)16-8-4-3-5-9-16/h3-12,19H,2,13-14H2,1H3,(H,21,22)
InChIKeyTYFRGGZXVLFVLA-UHFFFAOYSA-N
MW291.39 g/mol
LogP4.13
Rot. Bonds4

About N-[(4-phenyl-3,4-dihydronaphthalen-2-yl)methyl]propanamide

N-[(4-phenyl-3,4-dihydronaphthalen-2-yl)methyl]propanamide (PubChem CID 56926896) has the molecular formula C20H21NO and a molecular weight of 291.39 g/mol. Its IUPAC name is N-[(4-phenyl-3,4-dihydronaphthalen-2-yl)methyl]propanamide.

Molecular Properties

Compound NameN-[(4-phenyl-3,4-dihydronaphthalen-2-yl)methyl]propanamide
PubChem CID56926896
Molecular FormulaC20H21NO
Molecular Weight291.39 g/mol
Exact Mass291.16
IUPAC NameN-[(4-phenyl-3,4-dihydronaphthalen-2-yl)methyl]propanamide
SMILESCCC(=O)NCC1=Cc2ccccc2C(c2ccccc2)C1
InChIInChI=1S/C20H21NO/c1-2-20(22)21-14-15-12-17-10-6-7-11-18(17)19(13-15)16-8-4-3-5-9-16/h3-12,19H,2,13-14H2,1H3,(H,21,22)
InChIKeyTYFRGGZXVLFVLA-UHFFFAOYSA-N
XLogP4.13
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.39
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-[(4-phenyl-3,4-dihydronaphthalen-2-yl)methyl]propanamide 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-phenyl-3,4-dihydronaphthalen-2-yl)methyl]propanamide?
The IUPAC name of N-[(4-phenyl-3,4-dihydronaphthalen-2-yl)methyl]propanamide (CID 56926896) is N-[(4-phenyl-3,4-dihydronaphthalen-2-yl)methyl]propanamide.
What is the SMILES notation for N-[(4-phenyl-3,4-dihydronaphthalen-2-yl)methyl]propanamide?
The canonical SMILES for N-[(4-phenyl-3,4-dihydronaphthalen-2-yl)methyl]propanamide is CCC(=O)NCC1=Cc2ccccc2C(c2ccccc2)C1.
What is the InChIKey of N-[(4-phenyl-3,4-dihydronaphthalen-2-yl)methyl]propanamide?
The InChIKey is TYFRGGZXVLFVLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21NO/c1-2-20(22)21-14-15-12-17-10-6-7-11-18(17)19(13-15)16-8-4-3-5-9-16/h3-12,19H,2,13-14H2,1H3,(H,21,22).
What are the key properties of N-[(4-phenyl-3,4-dihydronaphthalen-2-yl)methyl]propanamide?
N-[(4-phenyl-3,4-dihydronaphthalen-2-yl)methyl]propanamide has a molecular weight of 291.39 g/mol, XLogP of 4.13, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-phenyl-3,4-dihydronaphthalen-2-yl)methyl]propanamide is sourced from PubChem (CID 56926896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).