1-[3-(dimethylamino)propyl-methylamino]-3-methoxypropan-2-ol

C10H24N2O2 — CID 63928362

IUPAC1-[3-(dimethylamino)propyl-methylamino]-3-methoxypropan-2-ol
SMILESCOCC(O)CN(C)CCCN(C)C
InChIInChI=1S/C10H24N2O2/c1-11(2)6-5-7-12(3)8-10(13)9-14-4/h10,13H,5-9H2,1-4H3
InChIKeyDLJPDCIOBYKOGP-UHFFFAOYSA-N
MW204.31 g/mol
LogP-0.12
Rot. Bonds8

About 1-[3-(dimethylamino)propyl-methylamino]-3-methoxypropan-2-ol

1-[3-(dimethylamino)propyl-methylamino]-3-methoxypropan-2-ol (PubChem CID 63928362) has the molecular formula C10H24N2O2 and a molecular weight of 204.31 g/mol. Its IUPAC name is 1-[3-(dimethylamino)propyl-methylamino]-3-methoxypropan-2-ol.

Molecular Properties

Compound Name1-[3-(dimethylamino)propyl-methylamino]-3-methoxypropan-2-ol
PubChem CID63928362
Molecular FormulaC10H24N2O2
Molecular Weight204.31 g/mol
Exact Mass204.18
IUPAC Name1-[3-(dimethylamino)propyl-methylamino]-3-methoxypropan-2-ol
SMILESCOCC(O)CN(C)CCCN(C)C
InChIInChI=1S/C10H24N2O2/c1-11(2)6-5-7-12(3)8-10(13)9-14-4/h10,13H,5-9H2,1-4H3
InChIKeyDLJPDCIOBYKOGP-UHFFFAOYSA-N
XLogP-0.12
TPSA35.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.31
LogP ≤ 5-0.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[3-fluoropropyl(methyl)amino]-3-methoxypropan-2-ol
CID 81113554
1-methoxy-3-[3-(2-methoxyethoxy)propyl-methylamino]propan-2-ol
CID 103412009
3-[3-(dimethylamino)propyl-methylamino]propane-1,2-diol
CID 22058011
1-[2-ethoxyethyl(methyl)amino]-3-methoxypropan-2-ol
CID 62013826
1-(2-methoxyethoxy)-3-[methyl(pentyl)amino]propan-2-ol
CID 106991621
4-(dimethylamino)-1-methoxybutan-2-ol
CID 115345876
1-[2-(dimethylamino)ethyl-propylamino]-3-methoxypropan-2-ol
CID 63929215
1-[3-benzhydryloxypropyl(methyl)amino]-3-methoxypropan-2-ol
CID 110194014
1-methoxy-3-[methyl(2,2,2-trifluoroethyl)amino]propan-2-ol
CID 62015935
1-[2-(dimethylamino)ethyl-methylamino]-3-ethoxypropan-2-ol
CID 63932351
1-[2-methoxyethyl(methyl)amino]-3-(1-methoxypropan-2-yloxy)propan-2-ol
CID 106991846
4-[[2-hydroxy-3-(1-methoxypropan-2-yloxy)propyl]-methylamino]butanoic acid
CID 106991392

Frequently Asked Questions

What is the IUPAC name of 1-[3-(dimethylamino)propyl-methylamino]-3-methoxypropan-2-ol?
The IUPAC name of 1-[3-(dimethylamino)propyl-methylamino]-3-methoxypropan-2-ol (CID 63928362) is 1-[3-(dimethylamino)propyl-methylamino]-3-methoxypropan-2-ol.
What is the SMILES notation for 1-[3-(dimethylamino)propyl-methylamino]-3-methoxypropan-2-ol?
The canonical SMILES for 1-[3-(dimethylamino)propyl-methylamino]-3-methoxypropan-2-ol is COCC(O)CN(C)CCCN(C)C.
What is the InChIKey of 1-[3-(dimethylamino)propyl-methylamino]-3-methoxypropan-2-ol?
The InChIKey is DLJPDCIOBYKOGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24N2O2/c1-11(2)6-5-7-12(3)8-10(13)9-14-4/h10,13H,5-9H2,1-4H3.
What are the key properties of 1-[3-(dimethylamino)propyl-methylamino]-3-methoxypropan-2-ol?
1-[3-(dimethylamino)propyl-methylamino]-3-methoxypropan-2-ol has a molecular weight of 204.31 g/mol, XLogP of -0.12, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(dimethylamino)propyl-methylamino]-3-methoxypropan-2-ol is sourced from PubChem (CID 63928362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).