N-[1-(2-methoxyphenyl)ethyl]-3-naphthalen-1-ylpropanamide

C22H23NO2 — CID 133184843

IUPACN-[1-(2-methoxyphenyl)ethyl]-3-naphthalen-1-ylpropanamide
SMILESCOc1ccccc1C(C)NC(=O)CCc1cccc2ccccc12
InChIInChI=1S/C22H23NO2/c1-16(19-11-5-6-13-21(19)25-2)23-22(24)15-14-18-10-7-9-17-8-3-4-12-20(17)18/h3-13,16H,14-15H2,1-2H3,(H,23,24)
InChIKeyPKTNONOWKCOWTF-UHFFFAOYSA-N
MW333.43 g/mol
LogP4.66
Rot. Bonds6

About N-[1-(2-methoxyphenyl)ethyl]-3-naphthalen-1-ylpropanamide

N-[1-(2-methoxyphenyl)ethyl]-3-naphthalen-1-ylpropanamide (PubChem CID 133184843) has the molecular formula C22H23NO2 and a molecular weight of 333.43 g/mol. Its IUPAC name is N-[1-(2-methoxyphenyl)ethyl]-3-naphthalen-1-ylpropanamide.

Molecular Properties

Compound NameN-[1-(2-methoxyphenyl)ethyl]-3-naphthalen-1-ylpropanamide
PubChem CID133184843
Molecular FormulaC22H23NO2
Molecular Weight333.43 g/mol
Exact Mass333.17
IUPAC NameN-[1-(2-methoxyphenyl)ethyl]-3-naphthalen-1-ylpropanamide
SMILESCOc1ccccc1C(C)NC(=O)CCc1cccc2ccccc12
InChIInChI=1S/C22H23NO2/c1-16(19-11-5-6-13-21(19)25-2)23-22(24)15-14-18-10-7-9-17-8-3-4-12-20(17)18/h3-13,16H,14-15H2,1-2H3,(H,23,24)
InChIKeyPKTNONOWKCOWTF-UHFFFAOYSA-N
XLogP4.66
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.43
LogP ≤ 54.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2,4-dichlorophenyl)-N-[(1S)-1-(2-methoxyphenyl)ethyl]propanamide
CID 100609739
3-(3,4-dimethylphenyl)-N-[1-(2-methoxyphenyl)ethyl]propanamide
CID 133160279
3-(furan-2-yl)-N-[1-(2-methoxyphenyl)ethyl]propanamide
CID 47097123
3-(ethylamino)-N-[1-(2-methoxyphenyl)ethyl]propanamide
CID 62834607
3-(2-ethoxyphenyl)-N-[(1S)-1-(2-methoxy-5-methylphenyl)ethyl]propanamide
CID 9264272
N-[1-(2,5-dimethoxyphenyl)ethyl]-3-(2-fluorophenyl)propanamide
CID 46664023
N-[(1R)-1-(2-methoxyphenyl)ethyl]-4-(methylamino)butanamide
CID 81387871
N-[2-[[(1R)-1-(2,5-dimethoxyphenyl)ethyl]amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide
CID 9477584
[2-[[(1S)-1-naphthalen-1-ylethyl]amino]-2-oxoethyl] 2,3-dimethoxybenzoate
CID 9203454
N-[1-(4-methoxy-3-methylphenyl)propyl]-3-naphthalen-1-ylpropanamide
CID 133161421
2-(2-ethylphenoxy)-N-[1-(2-methoxyphenyl)ethyl]acetamide
CID 51144695
N-[1-(3-bromophenyl)ethyl]-3-(2-methoxyphenyl)propanamide
CID 55575144

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-methoxyphenyl)ethyl]-3-naphthalen-1-ylpropanamide?
The IUPAC name of N-[1-(2-methoxyphenyl)ethyl]-3-naphthalen-1-ylpropanamide (CID 133184843) is N-[1-(2-methoxyphenyl)ethyl]-3-naphthalen-1-ylpropanamide.
What is the SMILES notation for N-[1-(2-methoxyphenyl)ethyl]-3-naphthalen-1-ylpropanamide?
The canonical SMILES for N-[1-(2-methoxyphenyl)ethyl]-3-naphthalen-1-ylpropanamide is COc1ccccc1C(C)NC(=O)CCc1cccc2ccccc12.
What is the InChIKey of N-[1-(2-methoxyphenyl)ethyl]-3-naphthalen-1-ylpropanamide?
The InChIKey is PKTNONOWKCOWTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23NO2/c1-16(19-11-5-6-13-21(19)25-2)23-22(24)15-14-18-10-7-9-17-8-3-4-12-20(17)18/h3-13,16H,14-15H2,1-2H3,(H,23,24).
What are the key properties of N-[1-(2-methoxyphenyl)ethyl]-3-naphthalen-1-ylpropanamide?
N-[1-(2-methoxyphenyl)ethyl]-3-naphthalen-1-ylpropanamide has a molecular weight of 333.43 g/mol, XLogP of 4.66, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-methoxyphenyl)ethyl]-3-naphthalen-1-ylpropanamide is sourced from PubChem (CID 133184843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).