4-[2-[methyl(propan-2-yl)amino]ethylamino]pentan-1-ol

C11H26N2O — CID 115971792

IUPAC4-[2-[methyl(propan-2-yl)amino]ethylamino]pentan-1-ol
SMILESCC(CCCO)NCCN(C)C(C)C
InChIInChI=1S/C11H26N2O/c1-10(2)13(4)8-7-12-11(3)6-5-9-14/h10-12,14H,5-9H2,1-4H3
InChIKeyUEJDUSOIPNSLEL-UHFFFAOYSA-N
MW202.34 g/mol
LogP1.08
Rot. Bonds8

About 4-[2-[methyl(propan-2-yl)amino]ethylamino]pentan-1-ol

4-[2-[methyl(propan-2-yl)amino]ethylamino]pentan-1-ol (PubChem CID 115971792) has the molecular formula C11H26N2O and a molecular weight of 202.34 g/mol. Its IUPAC name is 4-[2-[methyl(propan-2-yl)amino]ethylamino]pentan-1-ol.

Molecular Properties

Compound Name4-[2-[methyl(propan-2-yl)amino]ethylamino]pentan-1-ol
PubChem CID115971792
Molecular FormulaC11H26N2O
Molecular Weight202.34 g/mol
Exact Mass202.20
IUPAC Name4-[2-[methyl(propan-2-yl)amino]ethylamino]pentan-1-ol
SMILESCC(CCCO)NCCN(C)C(C)C
InChIInChI=1S/C11H26N2O/c1-10(2)13(4)8-7-12-11(3)6-5-9-14/h10-12,14H,5-9H2,1-4H3
InChIKeyUEJDUSOIPNSLEL-UHFFFAOYSA-N
XLogP1.08
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.34
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-N-[2-[methyl(propan-2-yl)amino]ethyl]propane-1,2-diamine
CID 103389816
3-[2-(dimethylamino)ethylamino]butan-1-ol
CID 83176952
N-(1-methoxypropan-2-yl)-N'-methyl-N'-propan-2-ylethane-1,2-diamine
CID 62574091
4-[3-[methyl(propan-2-yl)amino]propylamino]butan-1-ol
CID 106045730
2-[2-[methyl(propan-2-yl)amino]ethylamino]ethanol
CID 62641213
(4R)-4-(octylamino)pentan-1-ol
CID 98118615
4-[2-(2-methylprop-2-enoxy)ethylamino]pentan-1-ol
CID 115973599
5-[5-(diethylamino)pentan-2-ylamino]pentan-1-ol
CID 55053099
4-(4-methylsulfanylbutylamino)pentan-1-ol
CID 115972036
2-(6-methylheptan-2-ylamino)ethanol
CID 61469768
N'-hydroxy-3-[3-[methyl(propan-2-yl)amino]propylamino]butanimidamide
CID 106034042
N',N'-di(propan-2-yl)-N-(6,6,6-trifluorohexan-2-yl)ethane-1,2-diamine
CID 116533966

Frequently Asked Questions

What is the IUPAC name of 4-[2-[methyl(propan-2-yl)amino]ethylamino]pentan-1-ol?
The IUPAC name of 4-[2-[methyl(propan-2-yl)amino]ethylamino]pentan-1-ol (CID 115971792) is 4-[2-[methyl(propan-2-yl)amino]ethylamino]pentan-1-ol.
What is the SMILES notation for 4-[2-[methyl(propan-2-yl)amino]ethylamino]pentan-1-ol?
The canonical SMILES for 4-[2-[methyl(propan-2-yl)amino]ethylamino]pentan-1-ol is CC(CCCO)NCCN(C)C(C)C.
What is the InChIKey of 4-[2-[methyl(propan-2-yl)amino]ethylamino]pentan-1-ol?
The InChIKey is UEJDUSOIPNSLEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26N2O/c1-10(2)13(4)8-7-12-11(3)6-5-9-14/h10-12,14H,5-9H2,1-4H3.
What are the key properties of 4-[2-[methyl(propan-2-yl)amino]ethylamino]pentan-1-ol?
4-[2-[methyl(propan-2-yl)amino]ethylamino]pentan-1-ol has a molecular weight of 202.34 g/mol, XLogP of 1.08, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[methyl(propan-2-yl)amino]ethylamino]pentan-1-ol is sourced from PubChem (CID 115971792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).