N-[1-(cyclooctylamino)-1-oxopropan-2-yl]benzamide

C18H26N2O2 — CID 18158922

IUPACN-[1-(cyclooctylamino)-1-oxopropan-2-yl]benzamide
SMILESCC(NC(=O)c1ccccc1)C(=O)NC1CCCCCCC1
InChIInChI=1S/C18H26N2O2/c1-14(19-18(22)15-10-6-5-7-11-15)17(21)20-16-12-8-3-2-4-9-13-16/h5-7,10-11,14,16H,2-4,8-9,12-13H2,1H3,(H,19,22)(H,20,21)
InChIKeyRWMUHEKIOMODSW-UHFFFAOYSA-N
MW302.42 g/mol
LogP3.03
Rot. Bonds4

About N-[1-(cyclooctylamino)-1-oxopropan-2-yl]benzamide

N-[1-(cyclooctylamino)-1-oxopropan-2-yl]benzamide (PubChem CID 18158922) has the molecular formula C18H26N2O2 and a molecular weight of 302.42 g/mol. Its IUPAC name is N-[1-(cyclooctylamino)-1-oxopropan-2-yl]benzamide.

Molecular Properties

Compound NameN-[1-(cyclooctylamino)-1-oxopropan-2-yl]benzamide
PubChem CID18158922
Molecular FormulaC18H26N2O2
Molecular Weight302.42 g/mol
Exact Mass302.20
IUPAC NameN-[1-(cyclooctylamino)-1-oxopropan-2-yl]benzamide
SMILESCC(NC(=O)c1ccccc1)C(=O)NC1CCCCCCC1
InChIInChI=1S/C18H26N2O2/c1-14(19-18(22)15-10-6-5-7-11-15)17(21)20-16-12-8-3-2-4-9-13-16/h5-7,10-11,14,16H,2-4,8-9,12-13H2,1H3,(H,19,22)(H,20,21)
InChIKeyRWMUHEKIOMODSW-UHFFFAOYSA-N
XLogP3.03
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.42
LogP ≤ 53.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 12074090
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CID 7613190
N-[(2S)-4-(cyclohexylamino)-4-oxobutan-2-yl]benzamide
CID 39963895
N-[(2R)-1-(cyclooctylamino)-1-oxopropan-2-yl]furan-3-carboxamide
CID 94170401
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N-[1-oxo-1-(propan-2-ylamino)propan-2-yl]benzamide
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CID 171081015
N-[(2R)-1-(cyclooctylamino)-1-oxo-3-phenylpropan-2-yl]benzamide
CID 30823870
N-[1-[(1-cyclopentyl-2-phenylethyl)amino]-1-oxopropan-2-yl]benzamide
CID 86945414
N-(4-cyclohexylcyclooctyl)benzamide
CID 166761299
N-[(2R)-1-(cyclopentylamino)-1-oxopropan-2-yl]naphthalene-1-carboxamide
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CID 18108659

Frequently Asked Questions

What is the IUPAC name of N-[1-(cyclooctylamino)-1-oxopropan-2-yl]benzamide?
The IUPAC name of N-[1-(cyclooctylamino)-1-oxopropan-2-yl]benzamide (CID 18158922) is N-[1-(cyclooctylamino)-1-oxopropan-2-yl]benzamide.
What is the SMILES notation for N-[1-(cyclooctylamino)-1-oxopropan-2-yl]benzamide?
The canonical SMILES for N-[1-(cyclooctylamino)-1-oxopropan-2-yl]benzamide is CC(NC(=O)c1ccccc1)C(=O)NC1CCCCCCC1.
What is the InChIKey of N-[1-(cyclooctylamino)-1-oxopropan-2-yl]benzamide?
The InChIKey is RWMUHEKIOMODSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O2/c1-14(19-18(22)15-10-6-5-7-11-15)17(21)20-16-12-8-3-2-4-9-13-16/h5-7,10-11,14,16H,2-4,8-9,12-13H2,1H3,(H,19,22)(H,20,21).
What are the key properties of N-[1-(cyclooctylamino)-1-oxopropan-2-yl]benzamide?
N-[1-(cyclooctylamino)-1-oxopropan-2-yl]benzamide has a molecular weight of 302.42 g/mol, XLogP of 3.03, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(cyclooctylamino)-1-oxopropan-2-yl]benzamide is sourced from PubChem (CID 18158922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).