N-(5-cycloheptylcyclooctyl)cycloheptanecarboxamide

C23H41NO — CID 166761294

IUPACN-(5-cycloheptylcyclooctyl)cycloheptanecarboxamide
SMILESO=C(NC1CCCC(C2CCCCCC2)CCC1)C1CCCCCC1
InChIInChI=1S/C23H41NO/c25-23(21-13-7-3-4-8-14-21)24-22-17-9-15-20(16-10-18-22)19-11-5-1-2-6-12-19/h19-22H,1-18H2,(H,24,25)
InChIKeyQIFPTVFEVULKKJ-UHFFFAOYSA-N
MW347.59 g/mol
LogP6.38
Rot. Bonds3

About N-(5-cycloheptylcyclooctyl)cycloheptanecarboxamide

N-(5-cycloheptylcyclooctyl)cycloheptanecarboxamide (PubChem CID 166761294) has the molecular formula C23H41NO and a molecular weight of 347.59 g/mol. Its IUPAC name is N-(5-cycloheptylcyclooctyl)cycloheptanecarboxamide.

Molecular Properties

Compound NameN-(5-cycloheptylcyclooctyl)cycloheptanecarboxamide
PubChem CID166761294
Molecular FormulaC23H41NO
Molecular Weight347.59 g/mol
Exact Mass347.32
IUPAC NameN-(5-cycloheptylcyclooctyl)cycloheptanecarboxamide
SMILESO=C(NC1CCCC(C2CCCCCC2)CCC1)C1CCCCCC1
InChIInChI=1S/C23H41NO/c25-23(21-13-7-3-4-8-14-21)24-22-17-9-15-20(16-10-18-22)19-11-5-1-2-6-12-19/h19-22H,1-18H2,(H,24,25)
InChIKeyQIFPTVFEVULKKJ-UHFFFAOYSA-N
XLogP6.38
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500347.59
LogP ≤ 56.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-cycloheptylcycloheptanecarboxamide
CID 129091005
N-cyclodecylcyclododecanecarboxamide
CID 135182352
N-cyclopentylcyclobutanecarboxamide
CID 21158774
1-N,4-N-dicyclohexylcyclohexane-1,4-dicarboxamide
CID 2982201
N-cyclopropylcycloheptanecarboxamide
CID 62778853
N-cyclopropylcyclohexanecarboxamide
CID 3412875
5-[(1R)-1-aminoethyl]-N-cyclodecylcyclooctane-1-carboxamide
CID 126513454
5-(1-aminoethyl)-N-cyclooctylcyclodecane-1-carboxamide
CID 129211806
N-piperidin-4-ylcycloheptanecarboxamide
CID 62587546
acetaldehyde;N-cyclohexylcyclopropanecarboxamide
CID 143959717
N-(azepan-4-yl)cyclohexanecarboxamide
CID 105059767
4-(cyclobutylcarbamoyl)cyclohexane-1-carboxylic acid
CID 63784542

Frequently Asked Questions

What is the IUPAC name of N-(5-cycloheptylcyclooctyl)cycloheptanecarboxamide?
The IUPAC name of N-(5-cycloheptylcyclooctyl)cycloheptanecarboxamide (CID 166761294) is N-(5-cycloheptylcyclooctyl)cycloheptanecarboxamide.
What is the SMILES notation for N-(5-cycloheptylcyclooctyl)cycloheptanecarboxamide?
The canonical SMILES for N-(5-cycloheptylcyclooctyl)cycloheptanecarboxamide is O=C(NC1CCCC(C2CCCCCC2)CCC1)C1CCCCCC1.
What is the InChIKey of N-(5-cycloheptylcyclooctyl)cycloheptanecarboxamide?
The InChIKey is QIFPTVFEVULKKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H41NO/c25-23(21-13-7-3-4-8-14-21)24-22-17-9-15-20(16-10-18-22)19-11-5-1-2-6-12-19/h19-22H,1-18H2,(H,24,25).
What are the key properties of N-(5-cycloheptylcyclooctyl)cycloheptanecarboxamide?
N-(5-cycloheptylcyclooctyl)cycloheptanecarboxamide has a molecular weight of 347.59 g/mol, XLogP of 6.38, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-cycloheptylcyclooctyl)cycloheptanecarboxamide is sourced from PubChem (CID 166761294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).