1-[methyl(2-pyrrolidin-1-ylethyl)amino]butan-2-ol

C11H24N2O — CID 63207611

IUPAC1-[methyl(2-pyrrolidin-1-ylethyl)amino]butan-2-ol
SMILESCCC(O)CN(C)CCN1CCCC1
InChIInChI=1S/C11H24N2O/c1-3-11(14)10-12(2)8-9-13-6-4-5-7-13/h11,14H,3-10H2,1-2H3
InChIKeyRRCAREWVTZIADV-UHFFFAOYSA-N
MW200.33 g/mol
LogP0.78
Rot. Bonds6

About 1-[methyl(2-pyrrolidin-1-ylethyl)amino]butan-2-ol

1-[methyl(2-pyrrolidin-1-ylethyl)amino]butan-2-ol (PubChem CID 63207611) has the molecular formula C11H24N2O and a molecular weight of 200.33 g/mol. Its IUPAC name is 1-[methyl(2-pyrrolidin-1-ylethyl)amino]butan-2-ol.

Molecular Properties

Compound Name1-[methyl(2-pyrrolidin-1-ylethyl)amino]butan-2-ol
PubChem CID63207611
Molecular FormulaC11H24N2O
Molecular Weight200.33 g/mol
Exact Mass200.19
IUPAC Name1-[methyl(2-pyrrolidin-1-ylethyl)amino]butan-2-ol
SMILESCCC(O)CN(C)CCN1CCCC1
InChIInChI=1S/C11H24N2O/c1-3-11(14)10-12(2)8-9-13-6-4-5-7-13/h11,14H,3-10H2,1-2H3
InChIKeyRRCAREWVTZIADV-UHFFFAOYSA-N
XLogP0.78
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.33
LogP ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-N-methyl-1-N-(2-pyrrolidin-1-ylethyl)propane-1,2-diamine
CID 63207042
N-ethyl-N-methyl-2-piperidin-1-ylethanamine
CID 18427099
1-N,3,3-trimethyl-1-N-(2-pyrrolidin-1-ylethyl)butane-1,2-diamine
CID 63206956
1-N-methyl-1-N-(2-pyrrolidin-1-ylethyl)hexane-1,2-diamine
CID 63209097
N,N,N'-trimethyl-N'-(2-pyrrolidin-1-ylethyl)ethane-1,2-diamine
CID 156728125
1-[2-aminoethyl(methyl)amino]butan-2-ol
CID 62687204
4-[methyl(2-pyrrolidin-1-ylethyl)amino]-3-(propylamino)butan-1-ol
CID 64897970
1-(3,4-dimethylphenyl)-2-[methyl(2-pyrrolidin-1-ylethyl)amino]ethanol
CID 63210893
ethyl 3-[methyl(2-pyrrolidin-1-ylethyl)amino]-2-(propan-2-ylamino)propanoate
CID 63211159
1-[2-hydroxypropyl-[2-[2-hydroxypropyl-[2-[2-hydroxypropyl-[2-[4-(2-hydroxypropyl)piperazin-1-yl]ethyl]amino]ethyl]amino]ethyl]amino]butan-2-ol
CID 91079735
1-[2-[2-[bis(2-hydroxypropyl)amino]ethyl-(2-hydroxypropyl)amino]ethyl-[2-[4-(2-hydroxypropyl)piperazin-1-yl]ethyl]amino]butan-2-ol
CID 90974274
2-[methyl(2-pyrrolidin-1-ylethyl)amino]propan-1-ol
CID 115773280

Frequently Asked Questions

What is the IUPAC name of 1-[methyl(2-pyrrolidin-1-ylethyl)amino]butan-2-ol?
The IUPAC name of 1-[methyl(2-pyrrolidin-1-ylethyl)amino]butan-2-ol (CID 63207611) is 1-[methyl(2-pyrrolidin-1-ylethyl)amino]butan-2-ol.
What is the SMILES notation for 1-[methyl(2-pyrrolidin-1-ylethyl)amino]butan-2-ol?
The canonical SMILES for 1-[methyl(2-pyrrolidin-1-ylethyl)amino]butan-2-ol is CCC(O)CN(C)CCN1CCCC1.
What is the InChIKey of 1-[methyl(2-pyrrolidin-1-ylethyl)amino]butan-2-ol?
The InChIKey is RRCAREWVTZIADV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O/c1-3-11(14)10-12(2)8-9-13-6-4-5-7-13/h11,14H,3-10H2,1-2H3.
What are the key properties of 1-[methyl(2-pyrrolidin-1-ylethyl)amino]butan-2-ol?
1-[methyl(2-pyrrolidin-1-ylethyl)amino]butan-2-ol has a molecular weight of 200.33 g/mol, XLogP of 0.78, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[methyl(2-pyrrolidin-1-ylethyl)amino]butan-2-ol is sourced from PubChem (CID 63207611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).