N-cyclopentadecyl-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide

C23H35N3O2 — CID 72548098

IUPACN-cyclopentadecyl-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide
SMILESO=C(NC1CCCCCCCCCCCCCC1)c1cccc2[nH]c(=O)[nH]c12
InChIInChI=1S/C23H35N3O2/c27-22(19-16-13-17-20-21(19)26-23(28)25-20)24-18-14-11-9-7-5-3-1-2-4-6-8-10-12-15-18/h13,16-18H,1-12,14-15H2,(H,24,27)(H2,25,26,28)
InChIKeyNQIFBGZOHLSFBP-UHFFFAOYSA-N
MW385.55 g/mol
LogP5.43
Rot. Bonds2

About N-cyclopentadecyl-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide

N-cyclopentadecyl-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide (PubChem CID 72548098) has the molecular formula C23H35N3O2 and a molecular weight of 385.55 g/mol. Its IUPAC name is N-cyclopentadecyl-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide.

Molecular Properties

Compound NameN-cyclopentadecyl-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide
PubChem CID72548098
Molecular FormulaC23H35N3O2
Molecular Weight385.55 g/mol
Exact Mass385.27
IUPAC NameN-cyclopentadecyl-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide
SMILESO=C(NC1CCCCCCCCCCCCCC1)c1cccc2[nH]c(=O)[nH]c12
InChIInChI=1S/C23H35N3O2/c27-22(19-16-13-17-20-21(19)26-23(28)25-20)24-18-14-11-9-7-5-3-1-2-4-6-8-10-12-15-18/h13,16-18H,1-12,14-15H2,(H,24,27)(H2,25,26,28)
InChIKeyNQIFBGZOHLSFBP-UHFFFAOYSA-N
XLogP5.43
TPSA77.75 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500385.55
LogP ≤ 55.43
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

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N-cyclohexyl-1,2,3,4-tetrahydroquinoxaline-5-carboxamide
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N-(4-chlorophenyl)-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide
CID 110701251
2-[3-(cyclohexylcarbamoyl)-2-methylphenyl]acetic acid
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CID 669043
N-cyclopentyl-3-hydroxy-2-methylbenzamide
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Frequently Asked Questions

What is the IUPAC name of N-cyclopentadecyl-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide?
The IUPAC name of N-cyclopentadecyl-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide (CID 72548098) is N-cyclopentadecyl-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide.
What is the SMILES notation for N-cyclopentadecyl-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide?
The canonical SMILES for N-cyclopentadecyl-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide is O=C(NC1CCCCCCCCCCCCCC1)c1cccc2[nH]c(=O)[nH]c12.
What is the InChIKey of N-cyclopentadecyl-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide?
The InChIKey is NQIFBGZOHLSFBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H35N3O2/c27-22(19-16-13-17-20-21(19)26-23(28)25-20)24-18-14-11-9-7-5-3-1-2-4-6-8-10-12-15-18/h13,16-18H,1-12,14-15H2,(H,24,27)(H2,25,26,28).
What are the key properties of N-cyclopentadecyl-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide?
N-cyclopentadecyl-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide has a molecular weight of 385.55 g/mol, XLogP of 5.43, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentadecyl-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide is sourced from PubChem (CID 72548098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).