7-methyl-2-[2-[(6-methyl-1H-benzimidazol-2-yl)methoxy]acetyl]-2,7-diazaspiro[4.5]decan-6-one

C20H26N4O3 — CID 56759061

IUPAC7-methyl-2-[2-[(6-methyl-1H-benzimidazol-2-yl)methoxy]acetyl]-2,7-diazaspiro[4.5]decan-6-one
SMILESCc1ccc2nc(COCC(=O)N3CCC4(CCCN(C)C4=O)C3)[nH]c2c1
InChIInChI=1S/C20H26N4O3/c1-14-4-5-15-16(10-14)22-17(21-15)11-27-12-18(25)24-9-7-20(13-24)6-3-8-23(2)19(20)26/h4-5,10H,3,6-9,11-13H2,1-2H3,(H,21,22)
InChIKeyIZVCLWJPUXKFGH-UHFFFAOYSA-N
MW370.45 g/mol
LogP1.86
Rot. Bonds4

About 7-methyl-2-[2-[(6-methyl-1H-benzimidazol-2-yl)methoxy]acetyl]-2,7-diazaspiro[4.5]decan-6-one

7-methyl-2-[2-[(6-methyl-1H-benzimidazol-2-yl)methoxy]acetyl]-2,7-diazaspiro[4.5]decan-6-one (PubChem CID 56759061) has the molecular formula C20H26N4O3 and a molecular weight of 370.45 g/mol. Its IUPAC name is 7-methyl-2-[2-[(6-methyl-1H-benzimidazol-2-yl)methoxy]acetyl]-2,7-diazaspiro[4.5]decan-6-one.

Molecular Properties

Compound Name7-methyl-2-[2-[(6-methyl-1H-benzimidazol-2-yl)methoxy]acetyl]-2,7-diazaspiro[4.5]decan-6-one
PubChem CID56759061
Molecular FormulaC20H26N4O3
Molecular Weight370.45 g/mol
Exact Mass370.20
IUPAC Name7-methyl-2-[2-[(6-methyl-1H-benzimidazol-2-yl)methoxy]acetyl]-2,7-diazaspiro[4.5]decan-6-one
SMILESCc1ccc2nc(COCC(=O)N3CCC4(CCCN(C)C4=O)C3)[nH]c2c1
InChIInChI=1S/C20H26N4O3/c1-14-4-5-15-16(10-14)22-17(21-15)11-27-12-18(25)24-9-7-20(13-24)6-3-8-23(2)19(20)26/h4-5,10H,3,6-9,11-13H2,1-2H3,(H,21,22)
InChIKeyIZVCLWJPUXKFGH-UHFFFAOYSA-N
XLogP1.86
TPSA78.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.45
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 7-methyl-2-[2-[(6-methyl-1H-benzimidazol-2-yl)methoxy]acetyl]-2,7-diazaspiro[4.5]decan-6-one with MolForge

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Related Compounds

N-(2-methylpropyl)-N-[(3S,5R)-5-(morpholine-4-carbonyl)piperidin-3-yl]-1H-benzimidazole-2-carboxamide
CID 58355176
N-[4-(1H-benzimidazol-2-yl)phenyl]tetrahydro-2-furancarboxamide
CID 2941429
(5-methyl-1H-benzoimidazol-2-yl)(4-methylpiperazin-1-yl)methanone
CID 10083861
2-[(6-methyl-1H-benzimidazol-2-yl)methyl]-4-morpholin-4-yl-1H-pyrimidin-6-one
CID 136041785
4-morpholin-4-yl-2-[[6-(trifluoromethyl)-1H-benzimidazol-2-yl]methyl]-1H-pyrimidin-6-one
CID 136041787
1-[4-(1H-Benzoimidazol-2-yl)-piperidin-1-yl]-2-methoxy-ethanone
CID 1430429
3-[4-(1H-benzimidazol-2-yl)-1-piperidinyl]-1-(3-methylphenyl)-2,5-pyrrolidinedione
CID 2953320
3-[4-(1H-benzimidazol-2-yl)-1-piperidinyl]-1-benzyl-2,5-pyrrolidinedione
CID 2961811
N-[4-(6-methyl-1H-benzimidazol-2-yl)phenyl]oxolane-2-carboxamide
CID 2975207
2-methyl-1-(3-methylphenyl)-N-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide
CID 3655468
(Z)-2-(1H-benzimidazol-2-yl)-3-[4-(diethylamino)phenyl]-1-morpholin-4-ylprop-2-en-1-one
CID 15945228
1-(6-methyl-1H-benzimidazol-2-yl)-N-propylpiperidine-4-carboxamide
CID 16030900

Frequently Asked Questions

What is the IUPAC name of 7-methyl-2-[2-[(6-methyl-1H-benzimidazol-2-yl)methoxy]acetyl]-2,7-diazaspiro[4.5]decan-6-one?
The IUPAC name of 7-methyl-2-[2-[(6-methyl-1H-benzimidazol-2-yl)methoxy]acetyl]-2,7-diazaspiro[4.5]decan-6-one (CID 56759061) is 7-methyl-2-[2-[(6-methyl-1H-benzimidazol-2-yl)methoxy]acetyl]-2,7-diazaspiro[4.5]decan-6-one.
What is the SMILES notation for 7-methyl-2-[2-[(6-methyl-1H-benzimidazol-2-yl)methoxy]acetyl]-2,7-diazaspiro[4.5]decan-6-one?
The canonical SMILES for 7-methyl-2-[2-[(6-methyl-1H-benzimidazol-2-yl)methoxy]acetyl]-2,7-diazaspiro[4.5]decan-6-one is Cc1ccc2nc(COCC(=O)N3CCC4(CCCN(C)C4=O)C3)[nH]c2c1.
What is the InChIKey of 7-methyl-2-[2-[(6-methyl-1H-benzimidazol-2-yl)methoxy]acetyl]-2,7-diazaspiro[4.5]decan-6-one?
The InChIKey is IZVCLWJPUXKFGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N4O3/c1-14-4-5-15-16(10-14)22-17(21-15)11-27-12-18(25)24-9-7-20(13-24)6-3-8-23(2)19(20)26/h4-5,10H,3,6-9,11-13H2,1-2H3,(H,21,22).
What are the key properties of 7-methyl-2-[2-[(6-methyl-1H-benzimidazol-2-yl)methoxy]acetyl]-2,7-diazaspiro[4.5]decan-6-one?
7-methyl-2-[2-[(6-methyl-1H-benzimidazol-2-yl)methoxy]acetyl]-2,7-diazaspiro[4.5]decan-6-one has a molecular weight of 370.45 g/mol, XLogP of 1.86, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-2-[2-[(6-methyl-1H-benzimidazol-2-yl)methoxy]acetyl]-2,7-diazaspiro[4.5]decan-6-one is sourced from PubChem (CID 56759061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).