10-(methylamino)decane-1,1-diol

C11H25NO2 — CID 151651816

IUPAC10-(methylamino)decane-1,1-diol
SMILESCNCCCCCCCCCC(O)O
InChIInChI=1S/C11H25NO2/c1-12-10-8-6-4-2-3-5-7-9-11(13)14/h11-14H,2-10H2,1H3
InChIKeyQURAOOFJWPBMHK-UHFFFAOYSA-N
MW203.33 g/mol
LogP1.64
Rot. Bonds10

About 10-(methylamino)decane-1,1-diol

10-(methylamino)decane-1,1-diol (PubChem CID 151651816) has the molecular formula C11H25NO2 and a molecular weight of 203.33 g/mol. Its IUPAC name is 10-(methylamino)decane-1,1-diol.

Molecular Properties

Compound Name10-(methylamino)decane-1,1-diol
PubChem CID151651816
Molecular FormulaC11H25NO2
Molecular Weight203.33 g/mol
Exact Mass203.19
IUPAC Name10-(methylamino)decane-1,1-diol
SMILESCNCCCCCCCCCC(O)O
InChIInChI=1S/C11H25NO2/c1-12-10-8-6-4-2-3-5-7-9-11(13)14/h11-14H,2-10H2,1H3
InChIKeyQURAOOFJWPBMHK-UHFFFAOYSA-N
XLogP1.64
TPSA52.49 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 51.64
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

1,6-bis(methylamino)hexan-1-ol
CID 154254069
octane-1,1,8,8-tetrol
CID 88519685
N,6-dimethylheptan-1-amine;ethane
CID 169159475
(2S)-6-(methylamino)hexane-1,2-diol
CID 89283618
14-(oxidoamino)tetradecane-1,1-diol
CID 87132347
N,N'-dimethylhexane-1,6-diamine;hydrochloride
CID 154634683
N,5-dimethylhexan-1-amine;ethane
CID 142540507
2-[4-(methylamino)butyl]propane-1,3-diol
CID 59502430
1,1,1-trifluoro-6-(methylamino)hexan-2-ol
CID 84732703
7-(1-hydroxypropylamino)heptane-1,1-diol
CID 149148660
heptane-1,1-diol;hexane-1,1-diol
CID 161393558
decane;dodecane-1,1-diol
CID 162011285

Frequently Asked Questions

What is the IUPAC name of 10-(methylamino)decane-1,1-diol?
The IUPAC name of 10-(methylamino)decane-1,1-diol (CID 151651816) is 10-(methylamino)decane-1,1-diol.
What is the SMILES notation for 10-(methylamino)decane-1,1-diol?
The canonical SMILES for 10-(methylamino)decane-1,1-diol is CNCCCCCCCCCC(O)O.
What is the InChIKey of 10-(methylamino)decane-1,1-diol?
The InChIKey is QURAOOFJWPBMHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25NO2/c1-12-10-8-6-4-2-3-5-7-9-11(13)14/h11-14H,2-10H2,1H3.
What are the key properties of 10-(methylamino)decane-1,1-diol?
10-(methylamino)decane-1,1-diol has a molecular weight of 203.33 g/mol, XLogP of 1.64, 10 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 10-(methylamino)decane-1,1-diol is sourced from PubChem (CID 151651816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).