3-[[methyl(2-propan-2-yloxyethyl)amino]methyl]pyrrolidin-3-ol

C11H24N2O2 — CID 114761032

IUPAC3-[[methyl(2-propan-2-yloxyethyl)amino]methyl]pyrrolidin-3-ol
SMILESCC(C)OCCN(C)CC1(O)CCNC1
InChIInChI=1S/C11H24N2O2/c1-10(2)15-7-6-13(3)9-11(14)4-5-12-8-11/h10,12,14H,4-9H2,1-3H3
InChIKeyALVMMVQFAQPTAE-UHFFFAOYSA-N
MW216.32 g/mol
LogP0.07
Rot. Bonds6

About 3-[[methyl(2-propan-2-yloxyethyl)amino]methyl]pyrrolidin-3-ol

3-[[methyl(2-propan-2-yloxyethyl)amino]methyl]pyrrolidin-3-ol (PubChem CID 114761032) has the molecular formula C11H24N2O2 and a molecular weight of 216.32 g/mol. Its IUPAC name is 3-[[methyl(2-propan-2-yloxyethyl)amino]methyl]pyrrolidin-3-ol.

Molecular Properties

Compound Name3-[[methyl(2-propan-2-yloxyethyl)amino]methyl]pyrrolidin-3-ol
PubChem CID114761032
Molecular FormulaC11H24N2O2
Molecular Weight216.32 g/mol
Exact Mass216.18
IUPAC Name3-[[methyl(2-propan-2-yloxyethyl)amino]methyl]pyrrolidin-3-ol
SMILESCC(C)OCCN(C)CC1(O)CCNC1
InChIInChI=1S/C11H24N2O2/c1-10(2)15-7-6-13(3)9-11(14)4-5-12-8-11/h10,12,14H,4-9H2,1-3H3
InChIKeyALVMMVQFAQPTAE-UHFFFAOYSA-N
XLogP0.07
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 50.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-[[3-hydroxybutyl(methyl)amino]methyl]pyrrolidin-3-ol
CID 114761156
3-[[2-(2-methoxyethoxy)ethyl-methylamino]methyl]pyrrolidin-3-ol
CID 114761139
3-[[2-(2-methoxyphenoxy)ethyl-methylamino]methyl]pyrrolidin-3-ol
CID 114761278
3-[[2-(2-ethoxyphenoxy)ethyl-methylamino]methyl]pyrrolidin-3-ol
CID 114761043
[1-[[methyl(2-propan-2-yloxyethyl)amino]methyl]cyclopentyl]methanol
CID 81074081
N-[[1-(bromomethyl)cyclohexyl]methyl]-N-methyl-2-propan-2-yloxyethanamine
CID 81062152
N-butan-2-yl-2-[(3-hydroxypyrrolidin-3-yl)methyl-methylamino]acetamide
CID 114761300
3-[[ethyl(methyl)amino]methyl]piperidin-3-ol
CID 126971368
(3S)-3-[[(4-methoxyphenyl)methyl-methylamino]methyl]pyrrolidin-3-ol
CID 95804626
3-(diethylaminomethyl)pyrrolidin-3-ol;hydrochloride
CID 46941652
N-methyl-N-[(3-propan-2-yl-1-bicyclo[1.1.1]pentanyl)methyl]-2-propan-2-yloxyethanamine
CID 170680553
3-[[2-hydroxyethyl(methyl)amino]methyl]azetidin-3-ol
CID 174558313

Frequently Asked Questions

What is the IUPAC name of 3-[[methyl(2-propan-2-yloxyethyl)amino]methyl]pyrrolidin-3-ol?
The IUPAC name of 3-[[methyl(2-propan-2-yloxyethyl)amino]methyl]pyrrolidin-3-ol (CID 114761032) is 3-[[methyl(2-propan-2-yloxyethyl)amino]methyl]pyrrolidin-3-ol.
What is the SMILES notation for 3-[[methyl(2-propan-2-yloxyethyl)amino]methyl]pyrrolidin-3-ol?
The canonical SMILES for 3-[[methyl(2-propan-2-yloxyethyl)amino]methyl]pyrrolidin-3-ol is CC(C)OCCN(C)CC1(O)CCNC1.
What is the InChIKey of 3-[[methyl(2-propan-2-yloxyethyl)amino]methyl]pyrrolidin-3-ol?
The InChIKey is ALVMMVQFAQPTAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2/c1-10(2)15-7-6-13(3)9-11(14)4-5-12-8-11/h10,12,14H,4-9H2,1-3H3.
What are the key properties of 3-[[methyl(2-propan-2-yloxyethyl)amino]methyl]pyrrolidin-3-ol?
3-[[methyl(2-propan-2-yloxyethyl)amino]methyl]pyrrolidin-3-ol has a molecular weight of 216.32 g/mol, XLogP of 0.07, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[methyl(2-propan-2-yloxyethyl)amino]methyl]pyrrolidin-3-ol is sourced from PubChem (CID 114761032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).