1-cyclohexyl-N-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide

C20H28N4O2 — CID 3243473

IUPAC1-cyclohexyl-N-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide
SMILESO=C(NCCN1CCOCC1)c1ccc2c(c1)ncn2C1CCCCC1
InChIInChI=1S/C20H28N4O2/c25-20(21-8-9-23-10-12-26-13-11-23)16-6-7-19-18(14-16)22-15-24(19)17-4-2-1-3-5-17/h6-7,14-15,17H,1-5,8-13H2,(H,21,25)
InChIKeyNJAXOTVOKDTFRF-UHFFFAOYSA-N
MW356.47 g/mol
LogP2.60
Rot. Bonds5

About 1-cyclohexyl-N-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide

1-cyclohexyl-N-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide (PubChem CID 3243473) has the molecular formula C20H28N4O2 and a molecular weight of 356.47 g/mol. Its IUPAC name is 1-cyclohexyl-N-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide.

Molecular Properties

Compound Name1-cyclohexyl-N-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide
PubChem CID3243473
Molecular FormulaC20H28N4O2
Molecular Weight356.47 g/mol
Exact Mass356.22
IUPAC Name1-cyclohexyl-N-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide
SMILESO=C(NCCN1CCOCC1)c1ccc2c(c1)ncn2C1CCCCC1
InChIInChI=1S/C20H28N4O2/c25-20(21-8-9-23-10-12-26-13-11-23)16-6-7-19-18(14-16)22-15-24(19)17-4-2-1-3-5-17/h6-7,14-15,17H,1-5,8-13H2,(H,21,25)
InChIKeyNJAXOTVOKDTFRF-UHFFFAOYSA-N
XLogP2.60
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.47
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-cyclopropyl-N-(2-morpholin-4-ylethyl)imidazo[4,5-b]pyridine-6-carboxamide
CID 175644669
2-cyclohexyl-N-(2-morpholin-4-ylethyl)-1-oxo-3,4-dihydropyrazino[1,2-a]benzimidazole-8-carboxamide
CID 53148789
1-cyclopentyl-N-(3-propan-2-yloxypropyl)benzimidazole-5-carboxamide
CID 5113632
N-cycloheptyl-1-(2-pyrrolidin-1-ylethyl)benzimidazole-5-carboxamide
CID 53180053
2-(cyclopentylamino)-N-(2-morpholin-4-ylethyl)pyrimidine-5-carboxamide
CID 109249721
1-[4-[3-(4-fluorophenoxy)propoxy]phenyl]-N-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide
CID 67011702
5-N-cyclopentyl-3-N-(2-morpholin-4-ylethyl)pyridine-3,5-dicarboxamide
CID 109102673
2-amino-N-(2-morpholin-4-ylethyl)quinazoline-7-carboxamide
CID 143569714
4-(cycloheptylamino)-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide
CID 109207488
1-cyclopropyl-N-[(1R)-1-(4-morpholin-4-ylphenyl)ethyl]benzimidazole-5-carboxamide
CID 92625898
1-(4-ethoxyphenyl)-2-methyl-N-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide
CID 4103678
4-[(1-cyclohexylpyrazolo[3,4-d]pyrimidin-6-yl)amino]-N-(2-morpholin-4-ylethyl)benzamide
CID 59686558

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-N-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide?
The IUPAC name of 1-cyclohexyl-N-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide (CID 3243473) is 1-cyclohexyl-N-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide.
What is the SMILES notation for 1-cyclohexyl-N-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide?
The canonical SMILES for 1-cyclohexyl-N-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide is O=C(NCCN1CCOCC1)c1ccc2c(c1)ncn2C1CCCCC1.
What is the InChIKey of 1-cyclohexyl-N-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide?
The InChIKey is NJAXOTVOKDTFRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28N4O2/c25-20(21-8-9-23-10-12-26-13-11-23)16-6-7-19-18(14-16)22-15-24(19)17-4-2-1-3-5-17/h6-7,14-15,17H,1-5,8-13H2,(H,21,25).
What are the key properties of 1-cyclohexyl-N-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide?
1-cyclohexyl-N-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide has a molecular weight of 356.47 g/mol, XLogP of 2.60, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-N-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide is sourced from PubChem (CID 3243473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).