1-[3-(dimethylamino)propyl-prop-1-enylamino]propan-2-ol

C11H24N2O — CID 118162050

IUPAC1-[3-(dimethylamino)propyl-prop-1-enylamino]propan-2-ol
SMILESCC=CN(CCCN(C)C)CC(C)O
InChIInChI=1S/C11H24N2O/c1-5-7-13(10-11(2)14)9-6-8-12(3)4/h5,7,11,14H,6,8-10H2,1-4H3
InChIKeyRYPCOFNKKPQWNK-UHFFFAOYSA-N
MW200.33 g/mol
LogP1.15
Rot. Bonds7

About 1-[3-(dimethylamino)propyl-prop-1-enylamino]propan-2-ol

1-[3-(dimethylamino)propyl-prop-1-enylamino]propan-2-ol (PubChem CID 118162050) has the molecular formula C11H24N2O and a molecular weight of 200.33 g/mol. Its IUPAC name is 1-[3-(dimethylamino)propyl-prop-1-enylamino]propan-2-ol.

Molecular Properties

Compound Name1-[3-(dimethylamino)propyl-prop-1-enylamino]propan-2-ol
PubChem CID118162050
Molecular FormulaC11H24N2O
Molecular Weight200.33 g/mol
Exact Mass200.19
IUPAC Name1-[3-(dimethylamino)propyl-prop-1-enylamino]propan-2-ol
SMILESCC=CN(CCCN(C)C)CC(C)O
InChIInChI=1S/C11H24N2O/c1-5-7-13(10-11(2)14)9-6-8-12(3)4/h5,7,11,14H,6,8-10H2,1-4H3
InChIKeyRYPCOFNKKPQWNK-UHFFFAOYSA-N
XLogP1.15
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.33
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[3-(dimethylamino)propyl-[(2R)-2-hydroxypropyl]amino]propan-2-ol
CID 87581413
1-aminopropan-2-ol;1-[bis[3-(dimethylamino)propyl]amino]propan-2-ol
CID 174950006
chlorocopper;methanetriol;bis(N,N,N',N'-tetramethylpropane-1,3-diamine)
CID 5255455
1-[3-[bis(2-methylpropyl)amino]propyl-(2-hydroxypropyl)amino]propan-2-ol
CID 19889997
6-[3-(dimethylamino)propyl-methylamino]hexan-2-ol
CID 63701347
3-[3-(dimethylamino)propyl-methylamino]propane-1,2-diol
CID 22058011
1-[(ethylideneamino)-(2-hydroxypropyl)amino]propan-2-ol
CID 171780139
[bis[3-(dimethylamino)propyl]amino]-propan-2-ylcarbamic acid
CID 87591226
4-[3-(dimethylamino)propyl-methylamino]-3,3-dimethylbutan-2-ol
CID 66453701
(2S)-1-[[bis[(2R)-2-hydroxypropyl]amino]-[(2S)-2-hydroxypropyl]amino]propan-2-ol
CID 92557045
1-[3-[di(propan-2-yl)amino]propyl-(2-hydroxypropyl)amino]propan-2-ol
CID 19889984
N,N,20-trimethylhenicosan-1-amine;hydrochloride
CID 173055097

Frequently Asked Questions

What is the IUPAC name of 1-[3-(dimethylamino)propyl-prop-1-enylamino]propan-2-ol?
The IUPAC name of 1-[3-(dimethylamino)propyl-prop-1-enylamino]propan-2-ol (CID 118162050) is 1-[3-(dimethylamino)propyl-prop-1-enylamino]propan-2-ol.
What is the SMILES notation for 1-[3-(dimethylamino)propyl-prop-1-enylamino]propan-2-ol?
The canonical SMILES for 1-[3-(dimethylamino)propyl-prop-1-enylamino]propan-2-ol is CC=CN(CCCN(C)C)CC(C)O.
What is the InChIKey of 1-[3-(dimethylamino)propyl-prop-1-enylamino]propan-2-ol?
The InChIKey is RYPCOFNKKPQWNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O/c1-5-7-13(10-11(2)14)9-6-8-12(3)4/h5,7,11,14H,6,8-10H2,1-4H3.
What are the key properties of 1-[3-(dimethylamino)propyl-prop-1-enylamino]propan-2-ol?
1-[3-(dimethylamino)propyl-prop-1-enylamino]propan-2-ol has a molecular weight of 200.33 g/mol, XLogP of 1.15, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(dimethylamino)propyl-prop-1-enylamino]propan-2-ol is sourced from PubChem (CID 118162050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).