(3R)-1-[(1R)-1-[(3S)-pyrrolidin-3-yl]ethyl]pyrrolidin-3-ol

C10H20N2O — CID 129415903

IUPAC(3R)-1-[(1R)-1-[(3S)-pyrrolidin-3-yl]ethyl]pyrrolidin-3-ol
SMILESC[C@H]([C@H]1CCNC1)N1CC[C@@H](O)C1
InChIInChI=1S/C10H20N2O/c1-8(9-2-4-11-6-9)12-5-3-10(13)7-12/h8-11,13H,2-7H2,1H3/t8-,9+,10-/m1/s1
InChIKeyDTOPDICROYGMMP-KXUCPTDWSA-N
MW184.28 g/mol
LogP0.05
Rot. Bonds2

About (3R)-1-[(1R)-1-[(3S)-pyrrolidin-3-yl]ethyl]pyrrolidin-3-ol

(3R)-1-[(1R)-1-[(3S)-pyrrolidin-3-yl]ethyl]pyrrolidin-3-ol (PubChem CID 129415903) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is (3R)-1-[(1R)-1-[(3S)-pyrrolidin-3-yl]ethyl]pyrrolidin-3-ol.

Molecular Properties

Compound Name(3R)-1-[(1R)-1-[(3S)-pyrrolidin-3-yl]ethyl]pyrrolidin-3-ol
PubChem CID129415903
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name(3R)-1-[(1R)-1-[(3S)-pyrrolidin-3-yl]ethyl]pyrrolidin-3-ol
SMILESC[C@H]([C@H]1CCNC1)N1CC[C@@H](O)C1
InChIInChI=1S/C10H20N2O/c1-8(9-2-4-11-6-9)12-5-3-10(13)7-12/h8-11,13H,2-7H2,1H3/t8-,9+,10-/m1/s1
InChIKeyDTOPDICROYGMMP-KXUCPTDWSA-N
XLogP0.05
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 50.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[1-(2-azabicyclo[2.1.1]hexan-5-yl)ethyl]pyrrolidin-3-ol
CID 130961402
(3S)-1-propan-2-ylpyrrolidin-3-ol
CID 45087375
1-(1-cyclopropylethyl)piperidin-3-ol
CID 130668092
(3S)-1-[(2R)-3-methylbutan-2-yl]pyrrolidin-3-ol
CID 172508295
1-(1-aminoethyl)pyrrolidin-3-ol
CID 68831329
2-(1-pyrrolidin-3-ylethyl)-1,3-dihydroisoindole
CID 105470484
3-[1-(3-ethylazetidin-1-yl)ethyl]piperidine
CID 79678119
(3S)-1-[1-(4-fluorophenyl)ethyl]pyrrolidin-3-ol
CID 126787911
1-[1-(azetidin-3-yl)ethyl]piperazine
CID 173074477
bis(4-(1-pyrrolidin-1-ylethyl)piperidine);hydrate;tetrahydrochloride
CID 53398924
1-pyrrolidin-3-ylpyrrolidin-3-ol
CID 53407971
2-[(3R)-3-hydroxypyrrolidin-1-yl]propanenitrile
CID 66291661

Frequently Asked Questions

What is the IUPAC name of (3R)-1-[(1R)-1-[(3S)-pyrrolidin-3-yl]ethyl]pyrrolidin-3-ol?
The IUPAC name of (3R)-1-[(1R)-1-[(3S)-pyrrolidin-3-yl]ethyl]pyrrolidin-3-ol (CID 129415903) is (3R)-1-[(1R)-1-[(3S)-pyrrolidin-3-yl]ethyl]pyrrolidin-3-ol.
What is the SMILES notation for (3R)-1-[(1R)-1-[(3S)-pyrrolidin-3-yl]ethyl]pyrrolidin-3-ol?
The canonical SMILES for (3R)-1-[(1R)-1-[(3S)-pyrrolidin-3-yl]ethyl]pyrrolidin-3-ol is C[C@H]([C@H]1CCNC1)N1CC[C@@H](O)C1.
What is the InChIKey of (3R)-1-[(1R)-1-[(3S)-pyrrolidin-3-yl]ethyl]pyrrolidin-3-ol?
The InChIKey is DTOPDICROYGMMP-KXUCPTDWSA-N. The full InChI is InChI=1S/C10H20N2O/c1-8(9-2-4-11-6-9)12-5-3-10(13)7-12/h8-11,13H,2-7H2,1H3/t8-,9+,10-/m1/s1.
What are the key properties of (3R)-1-[(1R)-1-[(3S)-pyrrolidin-3-yl]ethyl]pyrrolidin-3-ol?
(3R)-1-[(1R)-1-[(3S)-pyrrolidin-3-yl]ethyl]pyrrolidin-3-ol has a molecular weight of 184.28 g/mol, XLogP of 0.05, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-[(1R)-1-[(3S)-pyrrolidin-3-yl]ethyl]pyrrolidin-3-ol is sourced from PubChem (CID 129415903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).