2-(cyclooctylamino)-N-[2-(4-fluoroanilino)-2-oxoethyl]acetamide

C18H26FN3O2 — CID 9265208

IUPAC2-(cyclooctylamino)-N-[2-(4-fluoroanilino)-2-oxoethyl]acetamide
SMILESO=C(CNC1CCCCCCC1)NCC(=O)Nc1ccc(F)cc1
InChIInChI=1S/C18H26FN3O2/c19-14-8-10-16(11-9-14)22-18(24)13-21-17(23)12-20-15-6-4-2-1-3-5-7-15/h8-11,15,20H,1-7,12-13H2,(H,21,23)(H,22,24)
InChIKeyBAHXALHIYDEPQE-UHFFFAOYSA-N
MW335.42 g/mol
LogP2.58
Rot. Bonds6

About 2-(cyclooctylamino)-N-[2-(4-fluoroanilino)-2-oxoethyl]acetamide

2-(cyclooctylamino)-N-[2-(4-fluoroanilino)-2-oxoethyl]acetamide (PubChem CID 9265208) has the molecular formula C18H26FN3O2 and a molecular weight of 335.42 g/mol. Its IUPAC name is 2-(cyclooctylamino)-N-[2-(4-fluoroanilino)-2-oxoethyl]acetamide.

Molecular Properties

Compound Name2-(cyclooctylamino)-N-[2-(4-fluoroanilino)-2-oxoethyl]acetamide
PubChem CID9265208
Molecular FormulaC18H26FN3O2
Molecular Weight335.42 g/mol
Exact Mass335.20
IUPAC Name2-(cyclooctylamino)-N-[2-(4-fluoroanilino)-2-oxoethyl]acetamide
SMILESO=C(CNC1CCCCCCC1)NCC(=O)Nc1ccc(F)cc1
InChIInChI=1S/C18H26FN3O2/c19-14-8-10-16(11-9-14)22-18(24)13-21-17(23)12-20-15-6-4-2-1-3-5-7-15/h8-11,15,20H,1-7,12-13H2,(H,21,23)(H,22,24)
InChIKeyBAHXALHIYDEPQE-UHFFFAOYSA-N
XLogP2.58
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.42
LogP ≤ 52.58
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-chlorophenyl)-2-(cyclohexylamino)acetamide
CID 788648
2-(cyclopentylamino)-N-(4-hydroxyphenyl)acetamide
CID 54918004
2-(cyclooctylamino)-N-(3,4-difluorophenyl)acetamide
CID 9265327
2-(cyclopentylamino)-N-(3,5-difluorophenyl)acetamide
CID 60703396
2-(cyclopentylamino)-N-[4-(trifluoromethyl)phenyl]acetamide
CID 60647058
2-(cyclopropylmethylamino)-N-[2-(4-fluoroanilino)-2-oxoethyl]acetamide
CID 119758034
N-[4-[[2-(cyclohexylamino)acetyl]amino]phenyl]-3-methylbutanamide
CID 54816270
N-[2-(4-cyclopentyloxyanilino)-2-oxoethyl]-4-fluorobenzamide
CID 38455253
2-(cyclooctylamino)-N-(2,4-difluorophenyl)acetamide
CID 9265336
4-[[2-(cyclohexylamino)acetyl]amino]-N-cyclopropylbenzamide
CID 1442013
2-(cyclopentyloxyamino)-N-(4-fluorophenyl)acetamide
CID 83228602
2-(cyclopentylamino)-N-[4-(trifluoromethylsulfanyl)phenyl]acetamide
CID 60850132

Frequently Asked Questions

What is the IUPAC name of 2-(cyclooctylamino)-N-[2-(4-fluoroanilino)-2-oxoethyl]acetamide?
The IUPAC name of 2-(cyclooctylamino)-N-[2-(4-fluoroanilino)-2-oxoethyl]acetamide (CID 9265208) is 2-(cyclooctylamino)-N-[2-(4-fluoroanilino)-2-oxoethyl]acetamide.
What is the SMILES notation for 2-(cyclooctylamino)-N-[2-(4-fluoroanilino)-2-oxoethyl]acetamide?
The canonical SMILES for 2-(cyclooctylamino)-N-[2-(4-fluoroanilino)-2-oxoethyl]acetamide is O=C(CNC1CCCCCCC1)NCC(=O)Nc1ccc(F)cc1.
What is the InChIKey of 2-(cyclooctylamino)-N-[2-(4-fluoroanilino)-2-oxoethyl]acetamide?
The InChIKey is BAHXALHIYDEPQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26FN3O2/c19-14-8-10-16(11-9-14)22-18(24)13-21-17(23)12-20-15-6-4-2-1-3-5-7-15/h8-11,15,20H,1-7,12-13H2,(H,21,23)(H,22,24).
What are the key properties of 2-(cyclooctylamino)-N-[2-(4-fluoroanilino)-2-oxoethyl]acetamide?
2-(cyclooctylamino)-N-[2-(4-fluoroanilino)-2-oxoethyl]acetamide has a molecular weight of 335.42 g/mol, XLogP of 2.58, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclooctylamino)-N-[2-(4-fluoroanilino)-2-oxoethyl]acetamide is sourced from PubChem (CID 9265208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).