N-pentyl-4-(propylamino)benzamide

C15H24N2O — CID 62185567

IUPACN-pentyl-4-(propylamino)benzamide
SMILESCCCCCNC(=O)c1ccc(NCCC)cc1
InChIInChI=1S/C15H24N2O/c1-3-5-6-12-17-15(18)13-7-9-14(10-8-13)16-11-4-2/h7-10,16H,3-6,11-12H2,1-2H3,(H,17,18)
InChIKeySIJYNQXSNCDZOL-UHFFFAOYSA-N
MW248.37 g/mol
LogP3.43
Rot. Bonds8

About N-pentyl-4-(propylamino)benzamide

N-pentyl-4-(propylamino)benzamide (PubChem CID 62185567) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is N-pentyl-4-(propylamino)benzamide.

Molecular Properties

Compound NameN-pentyl-4-(propylamino)benzamide
PubChem CID62185567
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC NameN-pentyl-4-(propylamino)benzamide
SMILESCCCCCNC(=O)c1ccc(NCCC)cc1
InChIInChI=1S/C15H24N2O/c1-3-5-6-12-17-15(18)13-7-9-14(10-8-13)16-11-4-2/h7-10,16H,3-6,11-12H2,1-2H3,(H,17,18)
InChIKeySIJYNQXSNCDZOL-UHFFFAOYSA-N
XLogP3.43
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 53.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(5-amino-5-oxopentyl)-4-(propylamino)benzamide
CID 106241045
N-(5-methylhexyl)-4-(propylamino)benzamide
CID 115327309
N-ethyl-4-(hexylamino)benzamide
CID 43728484
4-(propylamino)-N-(3-sulfamoylpropyl)benzamide
CID 62180515
N-[2-(dimethylamino)ethyl]-4-(octylamino)benzamide
CID 53361066
4-tert-butyl-N-nonylbenzamide
CID 4642451
N-(3-cyclopentylpropyl)-4-(propylamino)benzamide
CID 106015559
N-hexyl-4-(propanoylamino)benzamide
CID 17257310
N-decyl-4-hydroxybenzamide
CID 15277871
CID 131885807
CID 131885807
4-bromo-N-pentylbenzamide
CID 4167913
N-ethyl-4-[[2-(heptylamino)-2-oxoethyl]amino]benzamide
CID 54839527

Frequently Asked Questions

What is the IUPAC name of N-pentyl-4-(propylamino)benzamide?
The IUPAC name of N-pentyl-4-(propylamino)benzamide (CID 62185567) is N-pentyl-4-(propylamino)benzamide.
What is the SMILES notation for N-pentyl-4-(propylamino)benzamide?
The canonical SMILES for N-pentyl-4-(propylamino)benzamide is CCCCCNC(=O)c1ccc(NCCC)cc1.
What is the InChIKey of N-pentyl-4-(propylamino)benzamide?
The InChIKey is SIJYNQXSNCDZOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-3-5-6-12-17-15(18)13-7-9-14(10-8-13)16-11-4-2/h7-10,16H,3-6,11-12H2,1-2H3,(H,17,18).
What are the key properties of N-pentyl-4-(propylamino)benzamide?
N-pentyl-4-(propylamino)benzamide has a molecular weight of 248.37 g/mol, XLogP of 3.43, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-pentyl-4-(propylamino)benzamide is sourced from PubChem (CID 62185567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).