N-[(2R)-1-(cyclooctylamino)-1-oxo-3-phenylpropan-2-yl]benzamide

C24H30N2O2 — CID 30823870

IUPACN-[(2R)-1-(cyclooctylamino)-1-oxo-3-phenylpropan-2-yl]benzamide
SMILESO=C(N[C@H](Cc1ccccc1)C(=O)NC1CCCCCCC1)c1ccccc1
InChIInChI=1S/C24H30N2O2/c27-23(20-14-8-5-9-15-20)26-22(18-19-12-6-4-7-13-19)24(28)25-21-16-10-2-1-3-11-17-21/h4-9,12-15,21-22H,1-3,10-11,16-18H2,(H,25,28)(H,26,27)/t22-/m1/s1
InChIKeySTVXYYKOSJUREH-JOCHJYFZSA-N
MW378.52 g/mol
LogP4.26
Rot. Bonds6

About N-[(2R)-1-(cyclooctylamino)-1-oxo-3-phenylpropan-2-yl]benzamide

N-[(2R)-1-(cyclooctylamino)-1-oxo-3-phenylpropan-2-yl]benzamide (PubChem CID 30823870) has the molecular formula C24H30N2O2 and a molecular weight of 378.52 g/mol. Its IUPAC name is N-[(2R)-1-(cyclooctylamino)-1-oxo-3-phenylpropan-2-yl]benzamide.

Molecular Properties

Compound NameN-[(2R)-1-(cyclooctylamino)-1-oxo-3-phenylpropan-2-yl]benzamide
PubChem CID30823870
Molecular FormulaC24H30N2O2
Molecular Weight378.52 g/mol
Exact Mass378.23
IUPAC NameN-[(2R)-1-(cyclooctylamino)-1-oxo-3-phenylpropan-2-yl]benzamide
SMILESO=C(N[C@H](Cc1ccccc1)C(=O)NC1CCCCCCC1)c1ccccc1
InChIInChI=1S/C24H30N2O2/c27-23(20-14-8-5-9-15-20)26-22(18-19-12-6-4-7-13-19)24(28)25-21-16-10-2-1-3-11-17-21/h4-9,12-15,21-22H,1-3,10-11,16-18H2,(H,25,28)(H,26,27)/t22-/m1/s1
InChIKeySTVXYYKOSJUREH-JOCHJYFZSA-N
XLogP4.26
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.52
LogP ≤ 54.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-[(2R)-1-(cyclooctylamino)-1-oxo-3-phenylpropan-2-yl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[1-[(1-methylpiperidin-4-yl)amino]-1-oxo-3-phenylpropan-2-yl]benzamide
CID 71902056
N-[1-oxo-3-phenyl-1-(piperidin-3-ylamino)propan-2-yl]benzamide;hydrochloride
CID 119424821
N-[(2R)-1-[[(1R,2R)-2-methylcyclohexyl]amino]-1-oxo-3-phenylpropan-2-yl]benzamide
CID 126009171
N-cyclohexyl-2-[(2,2-diphenylacetyl)amino]-3-phenylpropanamide
CID 3523242
N-[1-[[1-(cyclopropanecarbonyl)piperidin-4-yl]amino]-1-oxo-3-phenylpropan-2-yl]benzamide
CID 46540029
N-[1-oxo-3-phenyl-1-[(1-propylpiperidin-4-yl)amino]propan-2-yl]benzamide
CID 78810004
(2R)-2-benzamido-N-[(2S)-1-(cyclohexylamino)-1-oxo-3-phenylpropan-2-yl]-3,4-dihydro-1H-naphthalene-2-carboxamide
CID 58928015
N-[1-oxo-3-phenyl-1-(1,2,3,4-tetrahydronaphthalen-1-ylamino)propan-2-yl]benzamide
CID 4783472
N-[1-(cyclooctylamino)-1-oxopropan-2-yl]benzamide
CID 18158922
N-[(2R)-1-(cyclopentylamino)-4-methylsulfonyl-1-oxobutan-2-yl]benzamide
CID 9209241
3-benzoyl-N-[(2S)-1-(cyclododecylamino)-3-hydroxy-1-oxopropan-2-yl]benzamide
CID 6723604
tert-butyl (4R)-4-benzamido-5-[[(2S)-1-(cyclohexylamino)-1-oxo-3-phenylpropan-2-yl]amino]-4-methyl-5-oxopentanoate
CID 10886134

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-1-(cyclooctylamino)-1-oxo-3-phenylpropan-2-yl]benzamide?
The IUPAC name of N-[(2R)-1-(cyclooctylamino)-1-oxo-3-phenylpropan-2-yl]benzamide (CID 30823870) is N-[(2R)-1-(cyclooctylamino)-1-oxo-3-phenylpropan-2-yl]benzamide.
What is the SMILES notation for N-[(2R)-1-(cyclooctylamino)-1-oxo-3-phenylpropan-2-yl]benzamide?
The canonical SMILES for N-[(2R)-1-(cyclooctylamino)-1-oxo-3-phenylpropan-2-yl]benzamide is O=C(N[C@H](Cc1ccccc1)C(=O)NC1CCCCCCC1)c1ccccc1.
What is the InChIKey of N-[(2R)-1-(cyclooctylamino)-1-oxo-3-phenylpropan-2-yl]benzamide?
The InChIKey is STVXYYKOSJUREH-JOCHJYFZSA-N. The full InChI is InChI=1S/C24H30N2O2/c27-23(20-14-8-5-9-15-20)26-22(18-19-12-6-4-7-13-19)24(28)25-21-16-10-2-1-3-11-17-21/h4-9,12-15,21-22H,1-3,10-11,16-18H2,(H,25,28)(H,26,27)/t22-/m1/s1.
What are the key properties of N-[(2R)-1-(cyclooctylamino)-1-oxo-3-phenylpropan-2-yl]benzamide?
N-[(2R)-1-(cyclooctylamino)-1-oxo-3-phenylpropan-2-yl]benzamide has a molecular weight of 378.52 g/mol, XLogP of 4.26, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-1-(cyclooctylamino)-1-oxo-3-phenylpropan-2-yl]benzamide is sourced from PubChem (CID 30823870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).