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

C19H26N4O2 — CID 3655573

IUPAC1-cyclopentyl-N-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide
SMILESO=C(NCCN1CCOCC1)c1ccc2c(c1)ncn2C1CCCC1
InChIInChI=1S/C19H26N4O2/c24-19(20-7-8-22-9-11-25-12-10-22)15-5-6-18-17(13-15)21-14-23(18)16-3-1-2-4-16/h5-6,13-14,16H,1-4,7-12H2,(H,20,24)
InChIKeyNUTRXDPWBIWRLK-UHFFFAOYSA-N
MW342.44 g/mol
LogP2.21
Rot. Bonds5

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

1-cyclopentyl-N-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide (PubChem CID 3655573) has the molecular formula C19H26N4O2 and a molecular weight of 342.44 g/mol. Its IUPAC name is 1-cyclopentyl-N-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide.

Molecular Properties

Compound Name1-cyclopentyl-N-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide
PubChem CID3655573
Molecular FormulaC19H26N4O2
Molecular Weight342.44 g/mol
Exact Mass342.21
IUPAC Name1-cyclopentyl-N-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide
SMILESO=C(NCCN1CCOCC1)c1ccc2c(c1)ncn2C1CCCC1
InChIInChI=1S/C19H26N4O2/c24-19(20-7-8-22-9-11-25-12-10-22)15-5-6-18-17(13-15)21-14-23(18)16-3-1-2-4-16/h5-6,13-14,16H,1-4,7-12H2,(H,20,24)
InChIKeyNUTRXDPWBIWRLK-UHFFFAOYSA-N
XLogP2.21
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.44
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-N-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide?
The IUPAC name of 1-cyclopentyl-N-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide (CID 3655573) is 1-cyclopentyl-N-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide.
What is the SMILES notation for 1-cyclopentyl-N-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide?
The canonical SMILES for 1-cyclopentyl-N-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide is O=C(NCCN1CCOCC1)c1ccc2c(c1)ncn2C1CCCC1.
What is the InChIKey of 1-cyclopentyl-N-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide?
The InChIKey is NUTRXDPWBIWRLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4O2/c24-19(20-7-8-22-9-11-25-12-10-22)15-5-6-18-17(13-15)21-14-23(18)16-3-1-2-4-16/h5-6,13-14,16H,1-4,7-12H2,(H,20,24).
What are the key properties of 1-cyclopentyl-N-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide?
1-cyclopentyl-N-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide has a molecular weight of 342.44 g/mol, XLogP of 2.21, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-N-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide is sourced from PubChem (CID 3655573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).