N-cyclooctyl-2-(propylamino)benzamide

C18H28N2O — CID 63500402

IUPACN-cyclooctyl-2-(propylamino)benzamide
SMILESCCCNc1ccccc1C(=O)NC1CCCCCCC1
InChIInChI=1S/C18H28N2O/c1-2-14-19-17-13-9-8-12-16(17)18(21)20-15-10-6-4-3-5-7-11-15/h8-9,12-13,15,19H,2-7,10-11,14H2,1H3,(H,20,21)
InChIKeyQCXZQFYKYCAARB-UHFFFAOYSA-N
MW288.44 g/mol
LogP4.35
Rot. Bonds5

About N-cyclooctyl-2-(propylamino)benzamide

N-cyclooctyl-2-(propylamino)benzamide (PubChem CID 63500402) has the molecular formula C18H28N2O and a molecular weight of 288.44 g/mol. Its IUPAC name is N-cyclooctyl-2-(propylamino)benzamide.

Molecular Properties

Compound NameN-cyclooctyl-2-(propylamino)benzamide
PubChem CID63500402
Molecular FormulaC18H28N2O
Molecular Weight288.44 g/mol
Exact Mass288.22
IUPAC NameN-cyclooctyl-2-(propylamino)benzamide
SMILESCCCNc1ccccc1C(=O)NC1CCCCCCC1
InChIInChI=1S/C18H28N2O/c1-2-14-19-17-13-9-8-12-16(17)18(21)20-15-10-6-4-3-5-7-11-15/h8-9,12-13,15,19H,2-7,10-11,14H2,1H3,(H,20,21)
InChIKeyQCXZQFYKYCAARB-UHFFFAOYSA-N
XLogP4.35
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.44
LogP ≤ 54.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-hydroxycyclohexyl)-2-(propylamino)benzamide
CID 62361158
N-cyclohexyl-5-methyl-2-(propylamino)benzamide
CID 62509311
N-(3,5-dimethylcyclohexyl)-2-(propylamino)benzamide
CID 64732342
N-cyclooctyl-3-(propylamino)pyridine-4-carboxamide
CID 105067977
N-[2-(cyclopropylamino)-2-oxoethyl]-2-(propylamino)benzamide
CID 62168218
2-(ethylamino)-N-(4-methylcyclohexyl)benzamide
CID 62171591
N-cyclopropyl-2-[[2-oxo-2-(propylamino)ethyl]amino]benzamide
CID 32906957
N-cycloheptyl-2-(propan-2-ylamino)benzamide
CID 63107657
N-cyclohexyl-2-(dodecanoylamino)benzamide
CID 25137451
2-[[2-[2-(cyclopentylcarbamoyl)anilino]-2-oxoethyl]amino]-N-cyclopropylbenzamide
CID 18144272
2-(butanoylamino)-N-cyclopropylbenzamide
CID 31824279
N-cyclohexyl-2-[(2-ethoxybenzoyl)amino]benzamide
CID 4926381

Frequently Asked Questions

What is the IUPAC name of N-cyclooctyl-2-(propylamino)benzamide?
The IUPAC name of N-cyclooctyl-2-(propylamino)benzamide (CID 63500402) is N-cyclooctyl-2-(propylamino)benzamide.
What is the SMILES notation for N-cyclooctyl-2-(propylamino)benzamide?
The canonical SMILES for N-cyclooctyl-2-(propylamino)benzamide is CCCNc1ccccc1C(=O)NC1CCCCCCC1.
What is the InChIKey of N-cyclooctyl-2-(propylamino)benzamide?
The InChIKey is QCXZQFYKYCAARB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O/c1-2-14-19-17-13-9-8-12-16(17)18(21)20-15-10-6-4-3-5-7-11-15/h8-9,12-13,15,19H,2-7,10-11,14H2,1H3,(H,20,21).
What are the key properties of N-cyclooctyl-2-(propylamino)benzamide?
N-cyclooctyl-2-(propylamino)benzamide has a molecular weight of 288.44 g/mol, XLogP of 4.35, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclooctyl-2-(propylamino)benzamide is sourced from PubChem (CID 63500402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).