N-ethyl-4-(hexylamino)benzamide

C15H24N2O — CID 43728484

IUPACN-ethyl-4-(hexylamino)benzamide
SMILESCCCCCCNc1ccc(C(=O)NCC)cc1
InChIInChI=1S/C15H24N2O/c1-3-5-6-7-12-17-14-10-8-13(9-11-14)15(18)16-4-2/h8-11,17H,3-7,12H2,1-2H3,(H,16,18)
InChIKeyCZXDNFSIWLERQA-UHFFFAOYSA-N
MW248.37 g/mol
LogP3.43
Rot. Bonds8

About N-ethyl-4-(hexylamino)benzamide

N-ethyl-4-(hexylamino)benzamide (PubChem CID 43728484) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is N-ethyl-4-(hexylamino)benzamide.

Molecular Properties

Compound NameN-ethyl-4-(hexylamino)benzamide
PubChem CID43728484
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC NameN-ethyl-4-(hexylamino)benzamide
SMILESCCCCCCNc1ccc(C(=O)NCC)cc1
InChIInChI=1S/C15H24N2O/c1-3-5-6-7-12-17-14-10-8-13(9-11-14)15(18)16-4-2/h8-11,17H,3-7,12H2,1-2H3,(H,16,18)
InChIKeyCZXDNFSIWLERQA-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-ethyl-4-[[2-(heptylamino)-2-oxoethyl]amino]benzamide
CID 54839527
N-pentyl-4-(propylamino)benzamide
CID 62185567
N-[2-(dimethylamino)ethyl]-4-(octylamino)benzamide
CID 53361066
N-ethyl-2-[4-(octylamino)phenyl]acetamide
CID 43737514
4-(heptylamino)-N-propan-2-ylbenzamide
CID 60935201
N-cyclopropyl-4-(pentylamino)benzamide
CID 43687480
4-(pentylamino)benzoate
CID 53422656
4-(butanoylamino)-N-hexylbenzamide
CID 3934901
4-(decanoylamino)-N-nonylbenzamide
CID 3464563
4-tert-butyl-N-nonylbenzamide
CID 4642451
ethane;N-ethyl-4-(ethylamino)benzamide;molecular hydrogen
CID 155715091
N-hexyl-4-propylbenzamide
CID 70894310

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-(hexylamino)benzamide?
The IUPAC name of N-ethyl-4-(hexylamino)benzamide (CID 43728484) is N-ethyl-4-(hexylamino)benzamide.
What is the SMILES notation for N-ethyl-4-(hexylamino)benzamide?
The canonical SMILES for N-ethyl-4-(hexylamino)benzamide is CCCCCCNc1ccc(C(=O)NCC)cc1.
What is the InChIKey of N-ethyl-4-(hexylamino)benzamide?
The InChIKey is CZXDNFSIWLERQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-3-5-6-7-12-17-14-10-8-13(9-11-14)15(18)16-4-2/h8-11,17H,3-7,12H2,1-2H3,(H,16,18).
What are the key properties of N-ethyl-4-(hexylamino)benzamide?
N-ethyl-4-(hexylamino)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-ethyl-4-(hexylamino)benzamide is sourced from PubChem (CID 43728484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).