N-[3-(dimethylamino)-1-naphthalen-2-ylpropyl]-3-phenylpropanamide

C24H28N2O — CID 15983816

IUPACN-[3-(dimethylamino)-1-naphthalen-2-ylpropyl]-3-phenylpropanamide
SMILESCN(C)CCC(NC(=O)CCc1ccccc1)c1ccc2ccccc2c1
InChIInChI=1S/C24H28N2O/c1-26(2)17-16-23(22-14-13-20-10-6-7-11-21(20)18-22)25-24(27)15-12-19-8-4-3-5-9-19/h3-11,13-14,18,23H,12,15-17H2,1-2H3,(H,25,27)
InChIKeyMNXBCQXRSCUKID-UHFFFAOYSA-N
MW360.50 g/mol
LogP4.58
Rot. Bonds8

About N-[3-(dimethylamino)-1-naphthalen-2-ylpropyl]-3-phenylpropanamide

N-[3-(dimethylamino)-1-naphthalen-2-ylpropyl]-3-phenylpropanamide (PubChem CID 15983816) has the molecular formula C24H28N2O and a molecular weight of 360.50 g/mol. Its IUPAC name is N-[3-(dimethylamino)-1-naphthalen-2-ylpropyl]-3-phenylpropanamide.

Molecular Properties

Compound NameN-[3-(dimethylamino)-1-naphthalen-2-ylpropyl]-3-phenylpropanamide
PubChem CID15983816
Molecular FormulaC24H28N2O
Molecular Weight360.50 g/mol
Exact Mass360.22
IUPAC NameN-[3-(dimethylamino)-1-naphthalen-2-ylpropyl]-3-phenylpropanamide
SMILESCN(C)CCC(NC(=O)CCc1ccccc1)c1ccc2ccccc2c1
InChIInChI=1S/C24H28N2O/c1-26(2)17-16-23(22-14-13-20-10-6-7-11-21(20)18-22)25-24(27)15-12-19-8-4-3-5-9-19/h3-11,13-14,18,23H,12,15-17H2,1-2H3,(H,25,27)
InChIKeyMNXBCQXRSCUKID-UHFFFAOYSA-N
XLogP4.58
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.50
LogP ≤ 54.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[3-(dimethylamino)-1-naphthalen-2-ylpropyl]-3-phenylpropanamide?
The IUPAC name of N-[3-(dimethylamino)-1-naphthalen-2-ylpropyl]-3-phenylpropanamide (CID 15983816) is N-[3-(dimethylamino)-1-naphthalen-2-ylpropyl]-3-phenylpropanamide.
What is the SMILES notation for N-[3-(dimethylamino)-1-naphthalen-2-ylpropyl]-3-phenylpropanamide?
The canonical SMILES for N-[3-(dimethylamino)-1-naphthalen-2-ylpropyl]-3-phenylpropanamide is CN(C)CCC(NC(=O)CCc1ccccc1)c1ccc2ccccc2c1.
What is the InChIKey of N-[3-(dimethylamino)-1-naphthalen-2-ylpropyl]-3-phenylpropanamide?
The InChIKey is MNXBCQXRSCUKID-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N2O/c1-26(2)17-16-23(22-14-13-20-10-6-7-11-21(20)18-22)25-24(27)15-12-19-8-4-3-5-9-19/h3-11,13-14,18,23H,12,15-17H2,1-2H3,(H,25,27).
What are the key properties of N-[3-(dimethylamino)-1-naphthalen-2-ylpropyl]-3-phenylpropanamide?
N-[3-(dimethylamino)-1-naphthalen-2-ylpropyl]-3-phenylpropanamide has a molecular weight of 360.50 g/mol, XLogP of 4.58, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(dimethylamino)-1-naphthalen-2-ylpropyl]-3-phenylpropanamide is sourced from PubChem (CID 15983816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).