(3R)-1-(6-methyl-2-pyridinyl)pyrrolidin-3-ol

C10H14N2O — CID 103801636

IUPAC(3R)-1-(6-methyl-2-pyridinyl)pyrrolidin-3-ol
SMILESCc1cccc(N2CC[C@@H](O)C2)n1
InChIInChI=1S/C10H14N2O/c1-8-3-2-4-10(11-8)12-6-5-9(13)7-12/h2-4,9,13H,5-7H2,1H3/t9-/m1/s1
InChIKeyZOOCBEPIAVAURS-SECBINFHSA-N
MW178.24 g/mol
LogP0.96
Rot. Bonds1

About (3R)-1-(6-methyl-2-pyridinyl)pyrrolidin-3-ol

(3R)-1-(6-methyl-2-pyridinyl)pyrrolidin-3-ol (PubChem CID 103801636) has the molecular formula C10H14N2O and a molecular weight of 178.24 g/mol. Its IUPAC name is (3R)-1-(6-methyl-2-pyridinyl)pyrrolidin-3-ol.

Molecular Properties

Compound Name(3R)-1-(6-methyl-2-pyridinyl)pyrrolidin-3-ol
PubChem CID103801636
Molecular FormulaC10H14N2O
Molecular Weight178.24 g/mol
Exact Mass178.11
IUPAC Name(3R)-1-(6-methyl-2-pyridinyl)pyrrolidin-3-ol
SMILESCc1cccc(N2CC[C@@H](O)C2)n1
InChIInChI=1S/C10H14N2O/c1-8-3-2-4-10(11-8)12-6-5-9(13)7-12/h2-4,9,13H,5-7H2,1H3/t9-/m1/s1
InChIKeyZOOCBEPIAVAURS-SECBINFHSA-N
XLogP0.96
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.24
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (3R)-1-(6-methyl-2-pyridinyl)pyrrolidin-3-ol?
The IUPAC name of (3R)-1-(6-methyl-2-pyridinyl)pyrrolidin-3-ol (CID 103801636) is (3R)-1-(6-methyl-2-pyridinyl)pyrrolidin-3-ol.
What is the SMILES notation for (3R)-1-(6-methyl-2-pyridinyl)pyrrolidin-3-ol?
The canonical SMILES for (3R)-1-(6-methyl-2-pyridinyl)pyrrolidin-3-ol is Cc1cccc(N2CC[C@@H](O)C2)n1.
What is the InChIKey of (3R)-1-(6-methyl-2-pyridinyl)pyrrolidin-3-ol?
The InChIKey is ZOOCBEPIAVAURS-SECBINFHSA-N. The full InChI is InChI=1S/C10H14N2O/c1-8-3-2-4-10(11-8)12-6-5-9(13)7-12/h2-4,9,13H,5-7H2,1H3/t9-/m1/s1.
What are the key properties of (3R)-1-(6-methyl-2-pyridinyl)pyrrolidin-3-ol?
(3R)-1-(6-methyl-2-pyridinyl)pyrrolidin-3-ol has a molecular weight of 178.24 g/mol, XLogP of 0.96, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-(6-methyl-2-pyridinyl)pyrrolidin-3-ol is sourced from PubChem (CID 103801636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).