2-[3-(dimethylamino)propyl-ethylamino]propan-2-ol

C10H24N2O — CID 174855893

IUPAC2-[3-(dimethylamino)propyl-ethylamino]propan-2-ol
SMILESCCN(CCCN(C)C)C(C)(C)O
InChIInChI=1S/C10H24N2O/c1-6-12(10(2,3)13)9-7-8-11(4)5/h13H,6-9H2,1-5H3
InChIKeyGLHYOPRVRZURKB-UHFFFAOYSA-N
MW188.31 g/mol
LogP0.99
Rot. Bonds6

About 2-[3-(dimethylamino)propyl-ethylamino]propan-2-ol

2-[3-(dimethylamino)propyl-ethylamino]propan-2-ol (PubChem CID 174855893) has the molecular formula C10H24N2O and a molecular weight of 188.31 g/mol. Its IUPAC name is 2-[3-(dimethylamino)propyl-ethylamino]propan-2-ol.

Molecular Properties

Compound Name2-[3-(dimethylamino)propyl-ethylamino]propan-2-ol
PubChem CID174855893
Molecular FormulaC10H24N2O
Molecular Weight188.31 g/mol
Exact Mass188.19
IUPAC Name2-[3-(dimethylamino)propyl-ethylamino]propan-2-ol
SMILESCCN(CCCN(C)C)C(C)(C)O
InChIInChI=1S/C10H24N2O/c1-6-12(10(2,3)13)9-7-8-11(4)5/h13H,6-9H2,1-5H3
InChIKeyGLHYOPRVRZURKB-UHFFFAOYSA-N
XLogP0.99
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.31
LogP ≤ 50.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-[ethyl(hydroxymethyl)amino]propan-2-ol
CID 87329716
6-(dimethylamino)-3-methylhexan-3-ol
CID 12542595
2-[4-[2-hydroxypropan-2-yl(methyl)amino]butyl-methylamino]propan-2-ol
CID 11470310
N'-[3-(dimethylamino)propyl]-N,N,N'-trimethylpropane-1,3-diamine;ethane
CID 171793143
N'-[3-[di(propan-2-yl)amino]propyl]-N'-ethyl-N,N-dimethylpropane-1,3-diamine
CID 178016346
N-[3-[3-(dimethylamino)propyl-methylamino]propyl]-N-methylhydroxylamine
CID 176937078
N'-ethyl-N,N,N'-trimethylpropane-1,3-diamine;propane
CID 142350934
N,N,N'-trimethyl-N'-[3-[methyl(propyl)amino]propyl]propane-1,3-diamine
CID 20621536
3-[tert-butyl(ethyl)amino]propan-1-ol
CID 138079476
2-N-[3-(dimethylamino)propyl]-2-methyl-2-N-propylbutane-1,2-diamine
CID 114524991
2-cyclopropyl-2-N-[3-(dimethylamino)propyl]-2-N-ethylbutane-1,2-diamine
CID 102991867
N'-[3-(dimethylamino)propyl]-N,N,N'-trimethylbutane-1,4-diamine;trihydrochloride
CID 131875706

Frequently Asked Questions

What is the IUPAC name of 2-[3-(dimethylamino)propyl-ethylamino]propan-2-ol?
The IUPAC name of 2-[3-(dimethylamino)propyl-ethylamino]propan-2-ol (CID 174855893) is 2-[3-(dimethylamino)propyl-ethylamino]propan-2-ol.
What is the SMILES notation for 2-[3-(dimethylamino)propyl-ethylamino]propan-2-ol?
The canonical SMILES for 2-[3-(dimethylamino)propyl-ethylamino]propan-2-ol is CCN(CCCN(C)C)C(C)(C)O.
What is the InChIKey of 2-[3-(dimethylamino)propyl-ethylamino]propan-2-ol?
The InChIKey is GLHYOPRVRZURKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24N2O/c1-6-12(10(2,3)13)9-7-8-11(4)5/h13H,6-9H2,1-5H3.
What are the key properties of 2-[3-(dimethylamino)propyl-ethylamino]propan-2-ol?
2-[3-(dimethylamino)propyl-ethylamino]propan-2-ol has a molecular weight of 188.31 g/mol, XLogP of 0.99, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(dimethylamino)propyl-ethylamino]propan-2-ol is sourced from PubChem (CID 174855893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).