(2R)-N-(2-acetylphenyl)-2-(cyclooctylamino)propanamide

C19H28N2O2 — CID 9444335

IUPAC(2R)-N-(2-acetylphenyl)-2-(cyclooctylamino)propanamide
SMILESCC(=O)c1ccccc1NC(=O)[C@@H](C)NC1CCCCCCC1
InChIInChI=1S/C19H28N2O2/c1-14(20-16-10-6-4-3-5-7-11-16)19(23)21-18-13-9-8-12-17(18)15(2)22/h8-9,12-14,16,20H,3-7,10-11H2,1-2H3,(H,21,23)/t14-/m1/s1
InChIKeySZOUPJIWIBMNQJ-CQSZACIVSA-N
MW316.44 g/mol
LogP3.92
Rot. Bonds5

About (2R)-N-(2-acetylphenyl)-2-(cyclooctylamino)propanamide

(2R)-N-(2-acetylphenyl)-2-(cyclooctylamino)propanamide (PubChem CID 9444335) has the molecular formula C19H28N2O2 and a molecular weight of 316.44 g/mol. Its IUPAC name is (2R)-N-(2-acetylphenyl)-2-(cyclooctylamino)propanamide.

Molecular Properties

Compound Name(2R)-N-(2-acetylphenyl)-2-(cyclooctylamino)propanamide
PubChem CID9444335
Molecular FormulaC19H28N2O2
Molecular Weight316.44 g/mol
Exact Mass316.22
IUPAC Name(2R)-N-(2-acetylphenyl)-2-(cyclooctylamino)propanamide
SMILESCC(=O)c1ccccc1NC(=O)[C@@H](C)NC1CCCCCCC1
InChIInChI=1S/C19H28N2O2/c1-14(20-16-10-6-4-3-5-7-11-16)19(23)21-18-13-9-8-12-17(18)15(2)22/h8-9,12-14,16,20H,3-7,10-11H2,1-2H3,(H,21,23)/t14-/m1/s1
InChIKeySZOUPJIWIBMNQJ-CQSZACIVSA-N
XLogP3.92
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.44
LogP ≤ 53.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[(2S)-2-chloropropanoyl]amino]-N-cyclohexylbenzamide
CID 92660383
1-(2-acetylphenyl)-3-propan-2-ylurea
CID 28738066
N-(2-acetamidophenyl)-2,2-dicyclohexylacetamide
CID 11175727
2-(cyclopentylamino)-N-(4-methylphenyl)propanamide
CID 60638781
2-(cycloheptylamino)-1-(2-methoxyphenyl)propan-1-one
CID 82100983
N-cyclohexyl-2-(cyclooctylamino)propanamide
CID 43083622
2-(cycloheptylamino)-N-cyclohexylpropanamide
CID 43236394
2-(cyclohexylamino)-N-cyclopentylpropanamide
CID 43083335
(2R)-N-(5-chloro-2-methoxyphenyl)-2-(cyclohexylamino)propanamide
CID 40602408
2-acetamido-N-[2-(piperidine-1-carbonyl)phenyl]propanamide
CID 78773400
N-cyclopentyl-2-(2-methylsulfanylpropanoylamino)benzamide
CID 43077712
(2R)-2-(cyclohexylamino)-N-(3,5-dichlorophenyl)propanamide
CID 2493886

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(2-acetylphenyl)-2-(cyclooctylamino)propanamide?
The IUPAC name of (2R)-N-(2-acetylphenyl)-2-(cyclooctylamino)propanamide (CID 9444335) is (2R)-N-(2-acetylphenyl)-2-(cyclooctylamino)propanamide.
What is the SMILES notation for (2R)-N-(2-acetylphenyl)-2-(cyclooctylamino)propanamide?
The canonical SMILES for (2R)-N-(2-acetylphenyl)-2-(cyclooctylamino)propanamide is CC(=O)c1ccccc1NC(=O)[C@@H](C)NC1CCCCCCC1.
What is the InChIKey of (2R)-N-(2-acetylphenyl)-2-(cyclooctylamino)propanamide?
The InChIKey is SZOUPJIWIBMNQJ-CQSZACIVSA-N. The full InChI is InChI=1S/C19H28N2O2/c1-14(20-16-10-6-4-3-5-7-11-16)19(23)21-18-13-9-8-12-17(18)15(2)22/h8-9,12-14,16,20H,3-7,10-11H2,1-2H3,(H,21,23)/t14-/m1/s1.
What are the key properties of (2R)-N-(2-acetylphenyl)-2-(cyclooctylamino)propanamide?
(2R)-N-(2-acetylphenyl)-2-(cyclooctylamino)propanamide has a molecular weight of 316.44 g/mol, XLogP of 3.92, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(2-acetylphenyl)-2-(cyclooctylamino)propanamide is sourced from PubChem (CID 9444335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).