5-[2-[di(propan-2-yl)amino]ethylamino]pentanamide

C13H29N3O — CID 114281581

IUPAC5-[2-[di(propan-2-yl)amino]ethylamino]pentanamide
SMILESCC(C)N(CCNCCCCC(N)=O)C(C)C
InChIInChI=1S/C13H29N3O/c1-11(2)16(12(3)4)10-9-15-8-6-5-7-13(14)17/h11-12,15H,5-10H2,1-4H3,(H2,14,17)
InChIKeyOYKMDTVVDIMQBQ-UHFFFAOYSA-N
MW243.39 g/mol
LogP1.35
Rot. Bonds10

About 5-[2-[di(propan-2-yl)amino]ethylamino]pentanamide

5-[2-[di(propan-2-yl)amino]ethylamino]pentanamide (PubChem CID 114281581) has the molecular formula C13H29N3O and a molecular weight of 243.39 g/mol. Its IUPAC name is 5-[2-[di(propan-2-yl)amino]ethylamino]pentanamide.

Molecular Properties

Compound Name5-[2-[di(propan-2-yl)amino]ethylamino]pentanamide
PubChem CID114281581
Molecular FormulaC13H29N3O
Molecular Weight243.39 g/mol
Exact Mass243.23
IUPAC Name5-[2-[di(propan-2-yl)amino]ethylamino]pentanamide
SMILESCC(C)N(CCNCCCCC(N)=O)C(C)C
InChIInChI=1S/C13H29N3O/c1-11(2)16(12(3)4)10-9-15-8-6-5-7-13(14)17/h11-12,15H,5-10H2,1-4H3,(H2,14,17)
InChIKeyOYKMDTVVDIMQBQ-UHFFFAOYSA-N
XLogP1.35
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.39
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

5-[2-[di(propan-2-yl)amino]ethylamino]pentan-1-ol
CID 62228638
12-(hexylamino)dodecanamide
CID 174861179
N-(3-fluoropropyl)-N',N'-di(propan-2-yl)ethane-1,2-diamine
CID 81106048
6-(decylamino)hexanamide
CID 13292350
N-carbamoyl-2-[2-[di(propan-2-yl)amino]ethylamino]acetamide
CID 28568651
4-[2-[di(propan-2-yl)amino]ethylamino]butanenitrile
CID 28568679
methyl 3-[(5-amino-5-oxopentyl)amino]-2-methylpropanoate
CID 106237219
4-[4-(tetradecylamino)butylamino]butanamide
CID 175024979
3-[2-[di(propan-2-yl)amino]ethylamino]-2-methylpropanoic acid
CID 43538375
N',N'-di(propan-2-yl)-N-(4,4,4-trifluorobutyl)ethane-1,2-diamine
CID 115513417
4-(propylamino)butanamide
CID 21468794
5-(3,3-diethoxypropylamino)pentanamide
CID 114162185

Frequently Asked Questions

What is the IUPAC name of 5-[2-[di(propan-2-yl)amino]ethylamino]pentanamide?
The IUPAC name of 5-[2-[di(propan-2-yl)amino]ethylamino]pentanamide (CID 114281581) is 5-[2-[di(propan-2-yl)amino]ethylamino]pentanamide.
What is the SMILES notation for 5-[2-[di(propan-2-yl)amino]ethylamino]pentanamide?
The canonical SMILES for 5-[2-[di(propan-2-yl)amino]ethylamino]pentanamide is CC(C)N(CCNCCCCC(N)=O)C(C)C.
What is the InChIKey of 5-[2-[di(propan-2-yl)amino]ethylamino]pentanamide?
The InChIKey is OYKMDTVVDIMQBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H29N3O/c1-11(2)16(12(3)4)10-9-15-8-6-5-7-13(14)17/h11-12,15H,5-10H2,1-4H3,(H2,14,17).
What are the key properties of 5-[2-[di(propan-2-yl)amino]ethylamino]pentanamide?
5-[2-[di(propan-2-yl)amino]ethylamino]pentanamide has a molecular weight of 243.39 g/mol, XLogP of 1.35, 10 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-[di(propan-2-yl)amino]ethylamino]pentanamide is sourced from PubChem (CID 114281581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).