N-[5-[5-(propylamino)pentylamino]pentyl]propanamide

C16H35N3O — CID 58435562

IUPACN-[5-[5-(propylamino)pentylamino]pentyl]propanamide
SMILESCCCNCCCCCNCCCCCNC(=O)CC
InChIInChI=1S/C16H35N3O/c1-3-11-17-12-7-5-8-13-18-14-9-6-10-15-19-16(20)4-2/h17-18H,3-15H2,1-2H3,(H,19,20)
InChIKeyARUITPAXDHMTSO-UHFFFAOYSA-N
MW285.48 g/mol
LogP2.44
Rot. Bonds15

About N-[5-[5-(propylamino)pentylamino]pentyl]propanamide

N-[5-[5-(propylamino)pentylamino]pentyl]propanamide (PubChem CID 58435562) has the molecular formula C16H35N3O and a molecular weight of 285.48 g/mol. Its IUPAC name is N-[5-[5-(propylamino)pentylamino]pentyl]propanamide.

Molecular Properties

Compound NameN-[5-[5-(propylamino)pentylamino]pentyl]propanamide
PubChem CID58435562
Molecular FormulaC16H35N3O
Molecular Weight285.48 g/mol
Exact Mass285.28
IUPAC NameN-[5-[5-(propylamino)pentylamino]pentyl]propanamide
SMILESCCCNCCCCCNCCCCCNC(=O)CC
InChIInChI=1S/C16H35N3O/c1-3-11-17-12-7-5-8-13-18-14-9-6-10-15-19-16(20)4-2/h17-18H,3-15H2,1-2H3,(H,19,20)
InChIKeyARUITPAXDHMTSO-UHFFFAOYSA-N
XLogP2.44
TPSA53.16 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds15
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.48
LogP ≤ 52.44
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

ethane;N-undecylpropanamide
CID 155706114
ethane;methanethiol;N-nonylpropanamide
CID 177150000
N-[7-[(2-chloroacetyl)amino]heptyl]propanamide
CID 163838006
N-(5-oxooctyl)-7-(propylamino)heptanamide
CID 59091179
3-(hexylamino)-N-tetradecylpropanamide
CID 58105395
N-[10-[(2-hydroxyacetyl)amino]decyl]propanamide;neodymium
CID 171554602
ethane;N-pentyl-6-(propanoylamino)hexanamide
CID 166555695
N-(12-oxotridecyl)propanamide
CID 171540592
11-(propanoylamino)undecanamide
CID 89244012
2-methyl-N-[6-(propylamino)hexyl]prop-2-enamide
CID 18464100
N,N'-dipropylicosane-1,20-diamine;dihydrobromide
CID 173263708
ethane;10-(propanoylamino)decanoic acid;11-(propanoylamino)undecanoic acid
CID 156732103

Frequently Asked Questions

What is the IUPAC name of N-[5-[5-(propylamino)pentylamino]pentyl]propanamide?
The IUPAC name of N-[5-[5-(propylamino)pentylamino]pentyl]propanamide (CID 58435562) is N-[5-[5-(propylamino)pentylamino]pentyl]propanamide.
What is the SMILES notation for N-[5-[5-(propylamino)pentylamino]pentyl]propanamide?
The canonical SMILES for N-[5-[5-(propylamino)pentylamino]pentyl]propanamide is CCCNCCCCCNCCCCCNC(=O)CC.
What is the InChIKey of N-[5-[5-(propylamino)pentylamino]pentyl]propanamide?
The InChIKey is ARUITPAXDHMTSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H35N3O/c1-3-11-17-12-7-5-8-13-18-14-9-6-10-15-19-16(20)4-2/h17-18H,3-15H2,1-2H3,(H,19,20).
What are the key properties of N-[5-[5-(propylamino)pentylamino]pentyl]propanamide?
N-[5-[5-(propylamino)pentylamino]pentyl]propanamide has a molecular weight of 285.48 g/mol, XLogP of 2.44, 15 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[5-(propylamino)pentylamino]pentyl]propanamide is sourced from PubChem (CID 58435562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).