N-(1H-imidazol-2-ylmethyl)-N-methyl-2-naphthalen-2-ylacetamide

C17H17N3O — CID 63929126

IUPACN-(1H-imidazol-2-ylmethyl)-N-methyl-2-naphthalen-2-ylacetamide
SMILESCN(Cc1ncc[nH]1)C(=O)Cc1ccc2ccccc2c1
InChIInChI=1S/C17H17N3O/c1-20(12-16-18-8-9-19-16)17(21)11-13-6-7-14-4-2-3-5-15(14)10-13/h2-10H,11-12H2,1H3,(H,18,19)
InChIKeyBPKSXIYAICFOJP-UHFFFAOYSA-N
MW279.34 g/mol
LogP2.76
Rot. Bonds4

About N-(1H-imidazol-2-ylmethyl)-N-methyl-2-naphthalen-2-ylacetamide

N-(1H-imidazol-2-ylmethyl)-N-methyl-2-naphthalen-2-ylacetamide (PubChem CID 63929126) has the molecular formula C17H17N3O and a molecular weight of 279.34 g/mol. Its IUPAC name is N-(1H-imidazol-2-ylmethyl)-N-methyl-2-naphthalen-2-ylacetamide.

Molecular Properties

Compound NameN-(1H-imidazol-2-ylmethyl)-N-methyl-2-naphthalen-2-ylacetamide
PubChem CID63929126
Molecular FormulaC17H17N3O
Molecular Weight279.34 g/mol
Exact Mass279.14
IUPAC NameN-(1H-imidazol-2-ylmethyl)-N-methyl-2-naphthalen-2-ylacetamide
SMILESCN(Cc1ncc[nH]1)C(=O)Cc1ccc2ccccc2c1
InChIInChI=1S/C17H17N3O/c1-20(12-16-18-8-9-19-16)17(21)11-13-6-7-14-4-2-3-5-15(14)10-13/h2-10H,11-12H2,1H3,(H,18,19)
InChIKeyBPKSXIYAICFOJP-UHFFFAOYSA-N
XLogP2.76
TPSA48.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(1H-imidazol-2-ylmethyl)-N-methyl-2-naphthalen-2-ylacetamide 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

N-(2-aminoethyl)-N-methyl-2-naphthalen-2-ylacetamide
CID 55149469
N-(2-bromoethyl)-N-methyl-2-naphthalen-2-ylacetamide
CID 80658951
2-[methyl-(2-naphthalen-2-ylacetyl)amino]acetic acid
CID 18071237
N-(1H-imidazol-2-ylmethyl)-N-methylquinoline-2-carboxamide
CID 63930575
2-chloro-N-(1H-imidazol-2-ylmethyl)-N-methylacetamide
CID 64511880
N-[(2-bromophenyl)methyl]-N-methyl-2-naphthalen-2-ylacetamide
CID 34866908
N-(1H-imidazol-2-ylmethyl)-N-methylnaphthalene-1-carboxamide
CID 63928694
methyl 3-[methyl-(2-naphthalen-2-ylacetyl)amino]propanoate
CID 61031185
2-tert-butylsulfanyl-N-(1H-imidazol-2-ylmethyl)-N-methylacetamide
CID 63939272
N-(1H-imidazol-2-ylmethyl)-N,2-dimethylpropanamide
CID 63929546
N-methyl-N-(naphthalen-2-ylmethyl)-2-(4-pyrrol-1-ylphenyl)acetamide
CID 46407692
2-amino-N-(1H-imidazol-2-ylmethyl)-N-methyl-2-phenylpropanamide
CID 64519424

Frequently Asked Questions

What is the IUPAC name of N-(1H-imidazol-2-ylmethyl)-N-methyl-2-naphthalen-2-ylacetamide?
The IUPAC name of N-(1H-imidazol-2-ylmethyl)-N-methyl-2-naphthalen-2-ylacetamide (CID 63929126) is N-(1H-imidazol-2-ylmethyl)-N-methyl-2-naphthalen-2-ylacetamide.
What is the SMILES notation for N-(1H-imidazol-2-ylmethyl)-N-methyl-2-naphthalen-2-ylacetamide?
The canonical SMILES for N-(1H-imidazol-2-ylmethyl)-N-methyl-2-naphthalen-2-ylacetamide is CN(Cc1ncc[nH]1)C(=O)Cc1ccc2ccccc2c1.
What is the InChIKey of N-(1H-imidazol-2-ylmethyl)-N-methyl-2-naphthalen-2-ylacetamide?
The InChIKey is BPKSXIYAICFOJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O/c1-20(12-16-18-8-9-19-16)17(21)11-13-6-7-14-4-2-3-5-15(14)10-13/h2-10H,11-12H2,1H3,(H,18,19).
What are the key properties of N-(1H-imidazol-2-ylmethyl)-N-methyl-2-naphthalen-2-ylacetamide?
N-(1H-imidazol-2-ylmethyl)-N-methyl-2-naphthalen-2-ylacetamide has a molecular weight of 279.34 g/mol, XLogP of 2.76, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-imidazol-2-ylmethyl)-N-methyl-2-naphthalen-2-ylacetamide is sourced from PubChem (CID 63929126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).