3-amino-N-methyl-N-(naphthalen-2-ylmethyl)propanamide;hydrochloride

C15H19ClN2O — CID 119270375

IUPAC3-amino-N-methyl-N-(naphthalen-2-ylmethyl)propanamide;hydrochloride
SMILESCN(Cc1ccc2ccccc2c1)C(=O)CCN.Cl
InChIInChI=1S/C15H18N2O.ClH/c1-17(15(18)8-9-16)11-12-6-7-13-4-2-3-5-14(13)10-12;/h2-7,10H,8-9,11,16H2,1H3;1H
InChIKeyMUERZJQFTFBZCY-UHFFFAOYSA-N
MW278.78 g/mol
LogP2.57
Rot. Bonds4

About 3-amino-N-methyl-N-(naphthalen-2-ylmethyl)propanamide;hydrochloride

3-amino-N-methyl-N-(naphthalen-2-ylmethyl)propanamide;hydrochloride (PubChem CID 119270375) has the molecular formula C15H19ClN2O and a molecular weight of 278.78 g/mol. Its IUPAC name is 3-amino-N-methyl-N-(naphthalen-2-ylmethyl)propanamide;hydrochloride.

Molecular Properties

Compound Name3-amino-N-methyl-N-(naphthalen-2-ylmethyl)propanamide;hydrochloride
PubChem CID119270375
Molecular FormulaC15H19ClN2O
Molecular Weight278.78 g/mol
Exact Mass278.12
IUPAC Name3-amino-N-methyl-N-(naphthalen-2-ylmethyl)propanamide;hydrochloride
SMILESCN(Cc1ccc2ccccc2c1)C(=O)CCN.Cl
InChIInChI=1S/C15H18N2O.ClH/c1-17(15(18)8-9-16)11-12-6-7-13-4-2-3-5-14(13)10-12;/h2-7,10H,8-9,11,16H2,1H3;1H
InChIKeyMUERZJQFTFBZCY-UHFFFAOYSA-N
XLogP2.57
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.78
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-amino-N-methyl-N-(naphthalen-2-ylmethyl)propanamide;hydrochloride?
The IUPAC name of 3-amino-N-methyl-N-(naphthalen-2-ylmethyl)propanamide;hydrochloride (CID 119270375) is 3-amino-N-methyl-N-(naphthalen-2-ylmethyl)propanamide;hydrochloride.
What is the SMILES notation for 3-amino-N-methyl-N-(naphthalen-2-ylmethyl)propanamide;hydrochloride?
The canonical SMILES for 3-amino-N-methyl-N-(naphthalen-2-ylmethyl)propanamide;hydrochloride is CN(Cc1ccc2ccccc2c1)C(=O)CCN.Cl.
What is the InChIKey of 3-amino-N-methyl-N-(naphthalen-2-ylmethyl)propanamide;hydrochloride?
The InChIKey is MUERZJQFTFBZCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O.ClH/c1-17(15(18)8-9-16)11-12-6-7-13-4-2-3-5-14(13)10-12;/h2-7,10H,8-9,11,16H2,1H3;1H.
What are the key properties of 3-amino-N-methyl-N-(naphthalen-2-ylmethyl)propanamide;hydrochloride?
3-amino-N-methyl-N-(naphthalen-2-ylmethyl)propanamide;hydrochloride has a molecular weight of 278.78 g/mol, XLogP of 2.57, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-methyl-N-(naphthalen-2-ylmethyl)propanamide;hydrochloride is sourced from PubChem (CID 119270375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).