N,2-dicyclohexyl-2-[2-(3-methylfuran-2-yl)-1,3-dihydrobenzimidazol-2-yl]acetamide

C26H35N3O2 — CID 68890623

IUPACN,2-dicyclohexyl-2-[2-(3-methylfuran-2-yl)-1,3-dihydrobenzimidazol-2-yl]acetamide
SMILESCc1ccoc1C1(C(C(=O)NC2CCCCC2)C2CCCCC2)Nc2ccccc2N1
InChIInChI=1S/C26H35N3O2/c1-18-16-17-31-24(18)26(28-21-14-8-9-15-22(21)29-26)23(19-10-4-2-5-11-19)25(30)27-20-12-6-3-7-13-20/h8-9,14-17,19-20,23,28-29H,2-7,10-13H2,1H3,(H,27,30)
InChIKeyMGFPNIJJJQHLAA-UHFFFAOYSA-N
MW421.59 g/mol
LogP5.92
Rot. Bonds5

About N,2-dicyclohexyl-2-[2-(3-methylfuran-2-yl)-1,3-dihydrobenzimidazol-2-yl]acetamide

N,2-dicyclohexyl-2-[2-(3-methylfuran-2-yl)-1,3-dihydrobenzimidazol-2-yl]acetamide (PubChem CID 68890623) has the molecular formula C26H35N3O2 and a molecular weight of 421.59 g/mol. Its IUPAC name is N,2-dicyclohexyl-2-[2-(3-methylfuran-2-yl)-1,3-dihydrobenzimidazol-2-yl]acetamide.

Molecular Properties

Compound NameN,2-dicyclohexyl-2-[2-(3-methylfuran-2-yl)-1,3-dihydrobenzimidazol-2-yl]acetamide
PubChem CID68890623
Molecular FormulaC26H35N3O2
Molecular Weight421.59 g/mol
Exact Mass421.27
IUPAC NameN,2-dicyclohexyl-2-[2-(3-methylfuran-2-yl)-1,3-dihydrobenzimidazol-2-yl]acetamide
SMILESCc1ccoc1C1(C(C(=O)NC2CCCCC2)C2CCCCC2)Nc2ccccc2N1
InChIInChI=1S/C26H35N3O2/c1-18-16-17-31-24(18)26(28-21-14-8-9-15-22(21)29-26)23(19-10-4-2-5-11-19)25(30)27-20-12-6-3-7-13-20/h8-9,14-17,19-20,23,28-29H,2-7,10-13H2,1H3,(H,27,30)
InChIKeyMGFPNIJJJQHLAA-UHFFFAOYSA-N
XLogP5.92
TPSA66.30 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500421.59
LogP ≤ 55.92
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N,2-dicyclohexyl-2-[2-(3,4-dimethylphenyl)-1,3-dihydrobenzimidazol-2-yl]acetamide
CID 68887889
2-[2-(4-chlorophenyl)-1,3-dihydrobenzimidazol-2-yl]-N,2-dicyclohexylacetamide
CID 68889730
N,2-dicyclohexyl-2-(2-naphthalen-2-yl-1,3-dihydrobenzimidazol-2-yl)acetamide
CID 68887043
2-[2-(4-chlorophenyl)-1,3-dihydrobenzimidazol-2-yl]-N-cyclohexyl-2-(oxan-4-yl)acetamide
CID 68888846
N,2-dicyclohexyl-2-[2-(7-ethoxy-1-benzofuran-2-yl)-1,3-dihydrobenzimidazol-2-yl]acetamide
CID 68886012
2-[2-(2-chlorophenyl)-5,6-difluoro-1,3-dihydrobenzimidazol-2-yl]-N,2-dicyclohexylacetamide
CID 68887472
N,2-dicyclohexyl-2-[2-[(2,3-dimethylphenoxy)methyl]-5-fluoro-1,3-dihydrobenzimidazol-2-yl]acetamide
CID 68728815
N,2-dicyclohexyl-2-[5,6-difluoro-2-(2-phenylethyl)-1,3-dihydrobenzimidazol-2-yl]acetamide
CID 68730718
2-[2-(4-aminophenyl)-1,3-dihydrobenzimidazol-2-yl]-N-cyclohexyl-4-methylpentanamide
CID 68886192
2-[2-(5-chlorothiophen-2-yl)-5-methoxy-1,3-dihydrobenzimidazol-2-yl]-N,2-dicyclohexylacetamide
CID 68887165
4-[[2-cyclohexyl-2-[5,6-difluoro-2-(4-methylphenyl)-1,3-dihydrobenzimidazol-2-yl]acetyl]amino]cyclohexane-1-carboxylic acid
CID 68730093
2-[2-(4-chloro-3-fluorophenyl)-5-methoxy-1,3-dihydrobenzimidazol-2-yl]-2-cyclohexyl-N-cyclopentylacetamide
CID 68885781

Frequently Asked Questions

What is the IUPAC name of N,2-dicyclohexyl-2-[2-(3-methylfuran-2-yl)-1,3-dihydrobenzimidazol-2-yl]acetamide?
The IUPAC name of N,2-dicyclohexyl-2-[2-(3-methylfuran-2-yl)-1,3-dihydrobenzimidazol-2-yl]acetamide (CID 68890623) is N,2-dicyclohexyl-2-[2-(3-methylfuran-2-yl)-1,3-dihydrobenzimidazol-2-yl]acetamide.
What is the SMILES notation for N,2-dicyclohexyl-2-[2-(3-methylfuran-2-yl)-1,3-dihydrobenzimidazol-2-yl]acetamide?
The canonical SMILES for N,2-dicyclohexyl-2-[2-(3-methylfuran-2-yl)-1,3-dihydrobenzimidazol-2-yl]acetamide is Cc1ccoc1C1(C(C(=O)NC2CCCCC2)C2CCCCC2)Nc2ccccc2N1.
What is the InChIKey of N,2-dicyclohexyl-2-[2-(3-methylfuran-2-yl)-1,3-dihydrobenzimidazol-2-yl]acetamide?
The InChIKey is MGFPNIJJJQHLAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H35N3O2/c1-18-16-17-31-24(18)26(28-21-14-8-9-15-22(21)29-26)23(19-10-4-2-5-11-19)25(30)27-20-12-6-3-7-13-20/h8-9,14-17,19-20,23,28-29H,2-7,10-13H2,1H3,(H,27,30).
What are the key properties of N,2-dicyclohexyl-2-[2-(3-methylfuran-2-yl)-1,3-dihydrobenzimidazol-2-yl]acetamide?
N,2-dicyclohexyl-2-[2-(3-methylfuran-2-yl)-1,3-dihydrobenzimidazol-2-yl]acetamide has a molecular weight of 421.59 g/mol, XLogP of 5.92, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dicyclohexyl-2-[2-(3-methylfuran-2-yl)-1,3-dihydrobenzimidazol-2-yl]acetamide is sourced from PubChem (CID 68890623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).