3-(1H-benzimidazol-2-yl)-N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylpropanamide

C23H23N3O2 — CID 17470683

IUPAC3-(1H-benzimidazol-2-yl)-N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylpropanamide
SMILESCOc1ccc2cc(CN(C)C(=O)CCc3nc4ccccc4[nH]3)ccc2c1
InChIInChI=1S/C23H23N3O2/c1-26(15-16-7-8-18-14-19(28-2)10-9-17(18)13-16)23(27)12-11-22-24-20-5-3-4-6-21(20)25-22/h3-10,13-14H,11-12,15H2,1-2H3,(H,24,25)
InChIKeyBBJKDUGDLLNRKD-UHFFFAOYSA-N
MW373.46 g/mol
LogP4.32
Rot. Bonds6

About 3-(1H-benzimidazol-2-yl)-N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylpropanamide

3-(1H-benzimidazol-2-yl)-N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylpropanamide (PubChem CID 17470683) has the molecular formula C23H23N3O2 and a molecular weight of 373.46 g/mol. Its IUPAC name is 3-(1H-benzimidazol-2-yl)-N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylpropanamide.

Molecular Properties

Compound Name3-(1H-benzimidazol-2-yl)-N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylpropanamide
PubChem CID17470683
Molecular FormulaC23H23N3O2
Molecular Weight373.46 g/mol
Exact Mass373.18
IUPAC Name3-(1H-benzimidazol-2-yl)-N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylpropanamide
SMILESCOc1ccc2cc(CN(C)C(=O)CCc3nc4ccccc4[nH]3)ccc2c1
InChIInChI=1S/C23H23N3O2/c1-26(15-16-7-8-18-14-19(28-2)10-9-17(18)13-16)23(27)12-11-22-24-20-5-3-4-6-21(20)25-22/h3-10,13-14H,11-12,15H2,1-2H3,(H,24,25)
InChIKeyBBJKDUGDLLNRKD-UHFFFAOYSA-N
XLogP4.32
TPSA58.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.46
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(1H-benzimidazol-2-yl)-N-methyl-N-[[4-(trifluoromethoxy)phenyl]methyl]propanamide
CID 38545493
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CID 24682495
N-[3-(1H-benzimidazol-2-yl)propyl]-6-methoxy-N-methylquinoline-2-carboxamide
CID 86859939
2-hydroxy-N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylacetamide
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CID 60988746
3-(1H-benzimidazol-2-yl)-N-[(5-chlorothiophen-2-yl)methyl]-N-methylpropanamide
CID 37207871
N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylquinoline-2-carboxamide
CID 9482645
N-(1H-benzimidazol-2-ylmethyl)-2-methoxy-N-methylacetamide
CID 47159982
3-(1H-benzimidazol-2-yl)-N-methyl-N-[3-(2-methylphenoxy)propyl]propanamide
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3-(1H-benzimidazol-2-yl)-N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-N-methylpropanamide
CID 42114788
3-(1H-benzimidazol-2-yl)-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]propanamide
CID 43045408
N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-methyl-3-(4-oxo-3H-quinazolin-2-yl)propanamide
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Frequently Asked Questions

What is the IUPAC name of 3-(1H-benzimidazol-2-yl)-N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylpropanamide?
The IUPAC name of 3-(1H-benzimidazol-2-yl)-N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylpropanamide (CID 17470683) is 3-(1H-benzimidazol-2-yl)-N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylpropanamide.
What is the SMILES notation for 3-(1H-benzimidazol-2-yl)-N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylpropanamide?
The canonical SMILES for 3-(1H-benzimidazol-2-yl)-N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylpropanamide is COc1ccc2cc(CN(C)C(=O)CCc3nc4ccccc4[nH]3)ccc2c1.
What is the InChIKey of 3-(1H-benzimidazol-2-yl)-N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylpropanamide?
The InChIKey is BBJKDUGDLLNRKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O2/c1-26(15-16-7-8-18-14-19(28-2)10-9-17(18)13-16)23(27)12-11-22-24-20-5-3-4-6-21(20)25-22/h3-10,13-14H,11-12,15H2,1-2H3,(H,24,25).
What are the key properties of 3-(1H-benzimidazol-2-yl)-N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylpropanamide?
3-(1H-benzimidazol-2-yl)-N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylpropanamide has a molecular weight of 373.46 g/mol, XLogP of 4.32, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1H-benzimidazol-2-yl)-N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylpropanamide is sourced from PubChem (CID 17470683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).