N-[5-(hexylamino)pentyl]propanamide

C14H30N2O — CID 58435580

IUPACN-[5-(hexylamino)pentyl]propanamide
SMILESCCCCCCNCCCCCNC(=O)CC
InChIInChI=1S/C14H30N2O/c1-3-5-6-8-11-15-12-9-7-10-13-16-14(17)4-2/h15H,3-13H2,1-2H3,(H,16,17)
InChIKeyASVMPLRXGVTFEC-UHFFFAOYSA-N
MW242.41 g/mol
LogP2.85
Rot. Bonds12

About N-[5-(hexylamino)pentyl]propanamide

N-[5-(hexylamino)pentyl]propanamide (PubChem CID 58435580) has the molecular formula C14H30N2O and a molecular weight of 242.41 g/mol. Its IUPAC name is N-[5-(hexylamino)pentyl]propanamide.

Molecular Properties

Compound NameN-[5-(hexylamino)pentyl]propanamide
PubChem CID58435580
Molecular FormulaC14H30N2O
Molecular Weight242.41 g/mol
Exact Mass242.24
IUPAC NameN-[5-(hexylamino)pentyl]propanamide
SMILESCCCCCCNCCCCCNC(=O)CC
InChIInChI=1S/C14H30N2O/c1-3-5-6-8-11-15-12-9-7-10-13-16-14(17)4-2/h15H,3-13H2,1-2H3,(H,16,17)
InChIKeyASVMPLRXGVTFEC-UHFFFAOYSA-N
XLogP2.85
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.41
LogP ≤ 52.85
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

N1-Acetylspermine
CID 916
Hexamethylene Bisacetamide
CID 3616
N-Acetylputrescine
CID 122356
N8-Acetylspermidine
CID 123689
N1-Acetylspermidine
CID 496
N-Acetylcadaverine
CID 189087
N-(2-Methylpropyl)hexanimidic acid
CID 239248
N-Dodecylacetamide
CID 19764
1,8-Diazacyclotetradecane-2,9-dione
CID 16
N-Hexylacetamide
CID 24129
Acetamide, N-nonyl-
CID 39431
N-Decylacetamide
CID 98880

Frequently Asked Questions

What is the IUPAC name of N-[5-(hexylamino)pentyl]propanamide?
The IUPAC name of N-[5-(hexylamino)pentyl]propanamide (CID 58435580) is N-[5-(hexylamino)pentyl]propanamide.
What is the SMILES notation for N-[5-(hexylamino)pentyl]propanamide?
The canonical SMILES for N-[5-(hexylamino)pentyl]propanamide is CCCCCCNCCCCCNC(=O)CC.
What is the InChIKey of N-[5-(hexylamino)pentyl]propanamide?
The InChIKey is ASVMPLRXGVTFEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O/c1-3-5-6-8-11-15-12-9-7-10-13-16-14(17)4-2/h15H,3-13H2,1-2H3,(H,16,17).
What are the key properties of N-[5-(hexylamino)pentyl]propanamide?
N-[5-(hexylamino)pentyl]propanamide has a molecular weight of 242.41 g/mol, XLogP of 2.85, 12 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(hexylamino)pentyl]propanamide is sourced from PubChem (CID 58435580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).