3-(2-aminopentan-3-yloxy)pentan-2-amine

C10H24N2O — CID 175582089

IUPAC3-(2-aminopentan-3-yloxy)pentan-2-amine
SMILESCCC(OC(CC)C(C)N)C(C)N
InChIInChI=1S/C10H24N2O/c1-5-9(7(3)11)13-10(6-2)8(4)12/h7-10H,5-6,11-12H2,1-4H3
InChIKeyUJROIZOUDPCQLJ-UHFFFAOYSA-N
MW188.31 g/mol
LogP1.25
Rot. Bonds6

About 3-(2-aminopentan-3-yloxy)pentan-2-amine

3-(2-aminopentan-3-yloxy)pentan-2-amine (PubChem CID 175582089) has the molecular formula C10H24N2O and a molecular weight of 188.31 g/mol. Its IUPAC name is 3-(2-aminopentan-3-yloxy)pentan-2-amine.

Molecular Properties

Compound Name3-(2-aminopentan-3-yloxy)pentan-2-amine
PubChem CID175582089
Molecular FormulaC10H24N2O
Molecular Weight188.31 g/mol
Exact Mass188.19
IUPAC Name3-(2-aminopentan-3-yloxy)pentan-2-amine
SMILESCCC(OC(CC)C(C)N)C(C)N
InChIInChI=1S/C10H24N2O/c1-5-9(7(3)11)13-10(6-2)8(4)12/h7-10H,5-6,11-12H2,1-4H3
InChIKeyUJROIZOUDPCQLJ-UHFFFAOYSA-N
XLogP1.25
TPSA61.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.31
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(2-hydroxypentan-3-yloxy)pentan-2-ol
CID 138539314
4-methylhexane-2,3-diamine
CID 123983512
(3R,4R,5R,6S)-3,6-dimethyloctane-4,5-diamine
CID 101057431
(2R)-2-amino-4-methylhexan-3-ol
CID 164643928
butan-2-amine;(2R)-butan-2-amine;methane
CID 160926504
3-(1,2-dihydroxypentan-3-yloxy)pentane-1,2-diol
CID 57312737
benzene-1,4-diol;2-methyl-3-(2-methylpentan-3-yloxy)pentane
CID 67743044
(3S,4R,5S,6R)-3,4,5,6-tetramethoxyoctane
CID 59693568
(4R)-2,4-dimethylhexan-3-amine
CID 59252919
CID 169430456
CID 169430456
3-(methoxymethyl)pentan-2-amine
CID 66437856
3-methoxypentane-1,2-diamine
CID 131111146

Frequently Asked Questions

What is the IUPAC name of 3-(2-aminopentan-3-yloxy)pentan-2-amine?
The IUPAC name of 3-(2-aminopentan-3-yloxy)pentan-2-amine (CID 175582089) is 3-(2-aminopentan-3-yloxy)pentan-2-amine.
What is the SMILES notation for 3-(2-aminopentan-3-yloxy)pentan-2-amine?
The canonical SMILES for 3-(2-aminopentan-3-yloxy)pentan-2-amine is CCC(OC(CC)C(C)N)C(C)N.
What is the InChIKey of 3-(2-aminopentan-3-yloxy)pentan-2-amine?
The InChIKey is UJROIZOUDPCQLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24N2O/c1-5-9(7(3)11)13-10(6-2)8(4)12/h7-10H,5-6,11-12H2,1-4H3.
What are the key properties of 3-(2-aminopentan-3-yloxy)pentan-2-amine?
3-(2-aminopentan-3-yloxy)pentan-2-amine has a molecular weight of 188.31 g/mol, XLogP of 1.25, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-aminopentan-3-yloxy)pentan-2-amine is sourced from PubChem (CID 175582089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).