1-[2-(dimethylamino)ethyl-propylamino]-3-methoxypropan-2-ol

C11H26N2O2 — CID 63929215

IUPAC1-[2-(dimethylamino)ethyl-propylamino]-3-methoxypropan-2-ol
SMILESCCCN(CCN(C)C)CC(O)COC
InChIInChI=1S/C11H26N2O2/c1-5-6-13(8-7-12(2)3)9-11(14)10-15-4/h11,14H,5-10H2,1-4H3
InChIKeySGYVWKCSYDGLLH-UHFFFAOYSA-N
MW218.34 g/mol
LogP0.27
Rot. Bonds9

About 1-[2-(dimethylamino)ethyl-propylamino]-3-methoxypropan-2-ol

1-[2-(dimethylamino)ethyl-propylamino]-3-methoxypropan-2-ol (PubChem CID 63929215) has the molecular formula C11H26N2O2 and a molecular weight of 218.34 g/mol. Its IUPAC name is 1-[2-(dimethylamino)ethyl-propylamino]-3-methoxypropan-2-ol.

Molecular Properties

Compound Name1-[2-(dimethylamino)ethyl-propylamino]-3-methoxypropan-2-ol
PubChem CID63929215
Molecular FormulaC11H26N2O2
Molecular Weight218.34 g/mol
Exact Mass218.20
IUPAC Name1-[2-(dimethylamino)ethyl-propylamino]-3-methoxypropan-2-ol
SMILESCCCN(CCN(C)C)CC(O)COC
InChIInChI=1S/C11H26N2O2/c1-5-6-13(8-7-12(2)3)9-11(14)10-15-4/h11,14H,5-10H2,1-4H3
InChIKeySGYVWKCSYDGLLH-UHFFFAOYSA-N
XLogP0.27
TPSA35.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 50.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[(dimethylamino)methyl-propylamino]-3-methoxypropan-2-ol
CID 123595558
1-[but-3-enyl(propyl)amino]-3-methoxypropan-2-ol
CID 90250583
1-[bis[2-(dimethylamino)ethyl]amino]butan-2-ol
CID 22055175
4-[2-(dimethylamino)ethyl-propylamino]-3-hydroxybutanoic acid
CID 82769678
1-[bis(2-phosphanyloxyethyl)amino]-3-methoxypropan-2-ol
CID 54197886
1-[3-(dimethylamino)propyl-methylamino]-3-methoxypropan-2-ol
CID 63928362
1-[(3-amino-2,2-dimethylpropyl)-propylamino]-3-methoxypropan-2-ol
CID 79661527
4-(dimethylamino)-1-methoxybutan-2-ol
CID 115345876
1-(dipropylamino)-3-propan-2-yloxypropan-2-ol
CID 60634039
1-[2-(dimethylamino)ethyl-propylamino]-3-piperazin-1-ylpropan-2-ol
CID 65448308
1-[bis(2-methoxyethyl)amino]-3-butoxypropan-2-ol
CID 107263774
1-butoxy-3-[2-hydroxyethyl(propyl)amino]propan-2-ol
CID 107263779

Frequently Asked Questions

What is the IUPAC name of 1-[2-(dimethylamino)ethyl-propylamino]-3-methoxypropan-2-ol?
The IUPAC name of 1-[2-(dimethylamino)ethyl-propylamino]-3-methoxypropan-2-ol (CID 63929215) is 1-[2-(dimethylamino)ethyl-propylamino]-3-methoxypropan-2-ol.
What is the SMILES notation for 1-[2-(dimethylamino)ethyl-propylamino]-3-methoxypropan-2-ol?
The canonical SMILES for 1-[2-(dimethylamino)ethyl-propylamino]-3-methoxypropan-2-ol is CCCN(CCN(C)C)CC(O)COC.
What is the InChIKey of 1-[2-(dimethylamino)ethyl-propylamino]-3-methoxypropan-2-ol?
The InChIKey is SGYVWKCSYDGLLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26N2O2/c1-5-6-13(8-7-12(2)3)9-11(14)10-15-4/h11,14H,5-10H2,1-4H3.
What are the key properties of 1-[2-(dimethylamino)ethyl-propylamino]-3-methoxypropan-2-ol?
1-[2-(dimethylamino)ethyl-propylamino]-3-methoxypropan-2-ol has a molecular weight of 218.34 g/mol, XLogP of 0.27, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(dimethylamino)ethyl-propylamino]-3-methoxypropan-2-ol is sourced from PubChem (CID 63929215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).