5-[2-[di(propan-2-yl)amino]ethylamino]pentan-1-ol

C13H30N2O — CID 62228638

IUPAC5-[2-[di(propan-2-yl)amino]ethylamino]pentan-1-ol
SMILESCC(C)N(CCNCCCCCO)C(C)C
InChIInChI=1S/C13H30N2O/c1-12(2)15(13(3)4)10-9-14-8-6-5-7-11-16/h12-14,16H,5-11H2,1-4H3
InChIKeyONRBTHZGTDLLSP-UHFFFAOYSA-N
MW230.40 g/mol
LogP1.86
Rot. Bonds10

About 5-[2-[di(propan-2-yl)amino]ethylamino]pentan-1-ol

5-[2-[di(propan-2-yl)amino]ethylamino]pentan-1-ol (PubChem CID 62228638) has the molecular formula C13H30N2O and a molecular weight of 230.40 g/mol. Its IUPAC name is 5-[2-[di(propan-2-yl)amino]ethylamino]pentan-1-ol.

Molecular Properties

Compound Name5-[2-[di(propan-2-yl)amino]ethylamino]pentan-1-ol
PubChem CID62228638
Molecular FormulaC13H30N2O
Molecular Weight230.40 g/mol
Exact Mass230.24
IUPAC Name5-[2-[di(propan-2-yl)amino]ethylamino]pentan-1-ol
SMILESCC(C)N(CCNCCCCCO)C(C)C
InChIInChI=1S/C13H30N2O/c1-12(2)15(13(3)4)10-9-14-8-6-5-7-11-16/h12-14,16H,5-11H2,1-4H3
InChIKeyONRBTHZGTDLLSP-UHFFFAOYSA-N
XLogP1.86
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.40
LogP ≤ 51.86
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

4-[3-[methyl(propan-2-yl)amino]propylamino]butan-1-ol
CID 106045730
5-[2-[di(propan-2-yl)amino]ethylamino]pentanamide
CID 114281581
N-(3-fluoropropyl)-N',N'-di(propan-2-yl)ethane-1,2-diamine
CID 81106048
12-(12-hydroxydodecylamino)dodecan-1-ol
CID 18618691
6-(7-methyloctylamino)hexan-1-ol
CID 107814970
4-[2-[di(propan-2-yl)amino]ethylamino]butanenitrile
CID 28568679
4-[2-[di(propan-2-yl)amino]ethylamino]-2-methylbutan-2-ol
CID 79361244
N',N'-di(propan-2-yl)-N-(4,4,4-trifluorobutyl)ethane-1,2-diamine
CID 115513417
4-[3-[4-[3-(4-hydroxybutylamino)propylamino]butylamino]propylamino]butan-1-ol
CID 178169165
8-(undecylamino)octan-1-ol
CID 139305047
3-[2-[di(propan-2-yl)amino]ethylamino]propane-1,2-diol
CID 76891683
[2-[2-[bis(disulfomethyl)amino]ethylamino]ethyl-(disulfomethyl)amino]methanedisulfonic acid
CID 18417942

Frequently Asked Questions

What is the IUPAC name of 5-[2-[di(propan-2-yl)amino]ethylamino]pentan-1-ol?
The IUPAC name of 5-[2-[di(propan-2-yl)amino]ethylamino]pentan-1-ol (CID 62228638) is 5-[2-[di(propan-2-yl)amino]ethylamino]pentan-1-ol.
What is the SMILES notation for 5-[2-[di(propan-2-yl)amino]ethylamino]pentan-1-ol?
The canonical SMILES for 5-[2-[di(propan-2-yl)amino]ethylamino]pentan-1-ol is CC(C)N(CCNCCCCCO)C(C)C.
What is the InChIKey of 5-[2-[di(propan-2-yl)amino]ethylamino]pentan-1-ol?
The InChIKey is ONRBTHZGTDLLSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H30N2O/c1-12(2)15(13(3)4)10-9-14-8-6-5-7-11-16/h12-14,16H,5-11H2,1-4H3.
What are the key properties of 5-[2-[di(propan-2-yl)amino]ethylamino]pentan-1-ol?
5-[2-[di(propan-2-yl)amino]ethylamino]pentan-1-ol has a molecular weight of 230.40 g/mol, XLogP of 1.86, 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]pentan-1-ol is sourced from PubChem (CID 62228638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).