1-[1-(dimethylamino)propan-2-yl-ethylamino]-3-(methylamino)propan-2-ol

C11H27N3O — CID 103188299

IUPAC1-[1-(dimethylamino)propan-2-yl-ethylamino]-3-(methylamino)propan-2-ol
SMILESCCN(CC(O)CNC)C(C)CN(C)C
InChIInChI=1S/C11H27N3O/c1-6-14(9-11(15)7-12-3)10(2)8-13(4)5/h10-12,15H,6-9H2,1-5H3
InChIKeyMEWKWEYUMJNJBC-UHFFFAOYSA-N
MW217.36 g/mol
LogP-0.16
Rot. Bonds8

About 1-[1-(dimethylamino)propan-2-yl-ethylamino]-3-(methylamino)propan-2-ol

1-[1-(dimethylamino)propan-2-yl-ethylamino]-3-(methylamino)propan-2-ol (PubChem CID 103188299) has the molecular formula C11H27N3O and a molecular weight of 217.36 g/mol. Its IUPAC name is 1-[1-(dimethylamino)propan-2-yl-ethylamino]-3-(methylamino)propan-2-ol.

Molecular Properties

Compound Name1-[1-(dimethylamino)propan-2-yl-ethylamino]-3-(methylamino)propan-2-ol
PubChem CID103188299
Molecular FormulaC11H27N3O
Molecular Weight217.36 g/mol
Exact Mass217.22
IUPAC Name1-[1-(dimethylamino)propan-2-yl-ethylamino]-3-(methylamino)propan-2-ol
SMILESCCN(CC(O)CNC)C(C)CN(C)C
InChIInChI=1S/C11H27N3O/c1-6-14(9-11(15)7-12-3)10(2)8-13(4)5/h10-12,15H,6-9H2,1-5H3
InChIKeyMEWKWEYUMJNJBC-UHFFFAOYSA-N
XLogP-0.16
TPSA38.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.36
LogP ≤ 5-0.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(dimethylamino)-3-(methylamino)propan-2-ol
CID 12700841
1-(methylamino)-3-[propan-2-yl(propyl)amino]propan-2-ol
CID 43269476
1-N-[1-(dimethylamino)propan-2-yl]-1-N-ethyl-2-N,3-dimethylbutane-1,2-diamine
CID 103188488
1-(methylamino)-3-[methyl(pentan-2-yl)amino]propan-2-ol
CID 43571982
1-N-[1-(dimethylamino)propan-2-yl]-1-N-ethylpropane-1,2-diamine
CID 103188353
(2R)-1-N-[1-(dimethylamino)propan-2-yl]-1-N-ethylpropane-1,2-diamine
CID 103188351
1-(methylamino)-3-[methyl(3-methylbutyl)amino]propan-2-ol
CID 61429791
2-[1-(dimethylamino)propan-2-yl-ethylamino]ethanethioamide
CID 103189022
N-[1-(dimethylamino)propan-2-yl]-N-ethyl-N',2-dimethyl-2-propylpropane-1,3-diamine
CID 103191300
1-N-[1-(dimethylamino)propan-2-yl]-1-N-ethyl-3-methoxy-2-N-methylpropane-1,2-diamine
CID 107505986
1-N-[1-(dimethylamino)propan-2-yl]-1-N-ethylbutane-1,2-diamine
CID 103188341
3-[1-(dimethylamino)propan-2-yl-ethylamino]-2-methylpropanenitrile
CID 103188911

Frequently Asked Questions

What is the IUPAC name of 1-[1-(dimethylamino)propan-2-yl-ethylamino]-3-(methylamino)propan-2-ol?
The IUPAC name of 1-[1-(dimethylamino)propan-2-yl-ethylamino]-3-(methylamino)propan-2-ol (CID 103188299) is 1-[1-(dimethylamino)propan-2-yl-ethylamino]-3-(methylamino)propan-2-ol.
What is the SMILES notation for 1-[1-(dimethylamino)propan-2-yl-ethylamino]-3-(methylamino)propan-2-ol?
The canonical SMILES for 1-[1-(dimethylamino)propan-2-yl-ethylamino]-3-(methylamino)propan-2-ol is CCN(CC(O)CNC)C(C)CN(C)C.
What is the InChIKey of 1-[1-(dimethylamino)propan-2-yl-ethylamino]-3-(methylamino)propan-2-ol?
The InChIKey is MEWKWEYUMJNJBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H27N3O/c1-6-14(9-11(15)7-12-3)10(2)8-13(4)5/h10-12,15H,6-9H2,1-5H3.
What are the key properties of 1-[1-(dimethylamino)propan-2-yl-ethylamino]-3-(methylamino)propan-2-ol?
1-[1-(dimethylamino)propan-2-yl-ethylamino]-3-(methylamino)propan-2-ol has a molecular weight of 217.36 g/mol, XLogP of -0.16, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(dimethylamino)propan-2-yl-ethylamino]-3-(methylamino)propan-2-ol is sourced from PubChem (CID 103188299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).