(2R)-1-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]propan-2-ol

C11H24N2O — CID 106932098

IUPAC(2R)-1-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]propan-2-ol
SMILESCC(CNC[C@@H](C)O)CN1CCCC1
InChIInChI=1S/C11H24N2O/c1-10(7-12-8-11(2)14)9-13-5-3-4-6-13/h10-12,14H,3-9H2,1-2H3/t10?,11-/m1/s1
InChIKeyQNLCOZZPVGXVTB-RRKGBCIJSA-N
MW200.33 g/mol
LogP0.69
Rot. Bonds6

About (2R)-1-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]propan-2-ol

(2R)-1-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]propan-2-ol (PubChem CID 106932098) has the molecular formula C11H24N2O and a molecular weight of 200.33 g/mol. Its IUPAC name is (2R)-1-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]propan-2-ol.

Molecular Properties

Compound Name(2R)-1-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]propan-2-ol
PubChem CID106932098
Molecular FormulaC11H24N2O
Molecular Weight200.33 g/mol
Exact Mass200.19
IUPAC Name(2R)-1-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]propan-2-ol
SMILESCC(CNC[C@@H](C)O)CN1CCCC1
InChIInChI=1S/C11H24N2O/c1-10(7-12-8-11(2)14)9-13-5-3-4-6-13/h10-12,14H,3-9H2,1-2H3/t10?,11-/m1/s1
InChIKeyQNLCOZZPVGXVTB-RRKGBCIJSA-N
XLogP0.69
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.33
LogP ≤ 50.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-3-pyrrolidin-1-yl-N-(2-pyrrolidin-1-ylethyl)propan-1-amine
CID 107911598
1-(2-methylbutylamino)-3-pyrrolidin-1-ylpropan-2-ol
CID 62692013
1-cyclopentyloxy-3-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]propan-2-ol
CID 62991174
N-butyl-2-methyl-3-pyrrolidin-1-ylpropan-1-amine
CID 60957473
4-[(2-hydroxy-3-pyrrolidin-1-ylpropyl)amino]-3-methylbutan-1-ol
CID 66106831
1-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]-3-pyrazol-1-ylpropan-2-ol
CID 62991007
1-[2-(azepan-1-yl)ethylamino]propan-2-ol
CID 104594544
N-(2-methyl-3-pyrrolidin-1-ylpropyl)formamide
CID 64992591
2-methyl-N-[(1-methylpiperidin-4-yl)methyl]-3-pyrrolidin-1-ylpropan-1-amine
CID 55135059
1-(azacyclododec-1-yl)propan-2-ol
CID 58868254
N-(2-methyl-3-piperidin-1-ylpropyl)formamide
CID 64992840
N-(2-methyl-3-pyrrolidin-1-ylpropyl)acetamide
CID 61062993

Frequently Asked Questions

What is the IUPAC name of (2R)-1-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]propan-2-ol?
The IUPAC name of (2R)-1-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]propan-2-ol (CID 106932098) is (2R)-1-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]propan-2-ol.
What is the SMILES notation for (2R)-1-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]propan-2-ol?
The canonical SMILES for (2R)-1-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]propan-2-ol is CC(CNC[C@@H](C)O)CN1CCCC1.
What is the InChIKey of (2R)-1-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]propan-2-ol?
The InChIKey is QNLCOZZPVGXVTB-RRKGBCIJSA-N. The full InChI is InChI=1S/C11H24N2O/c1-10(7-12-8-11(2)14)9-13-5-3-4-6-13/h10-12,14H,3-9H2,1-2H3/t10?,11-/m1/s1.
What are the key properties of (2R)-1-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]propan-2-ol?
(2R)-1-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]propan-2-ol has a molecular weight of 200.33 g/mol, XLogP of 0.69, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]propan-2-ol is sourced from PubChem (CID 106932098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).