1-[1-(5-propan-2-yl-2-pyridinyl)pyrrolidin-3-yl]azetidin-3-ol

C15H23N3O — CID 163566673

IUPAC1-[1-(5-propan-2-yl-2-pyridinyl)pyrrolidin-3-yl]azetidin-3-ol
SMILESCC(C)c1ccc(N2CCC(N3CC(O)C3)C2)nc1
InChIInChI=1S/C15H23N3O/c1-11(2)12-3-4-15(16-7-12)17-6-5-13(8-17)18-9-14(19)10-18/h3-4,7,11,13-14,19H,5-6,8-10H2,1-2H3
InChIKeyFVUSFOMHAPEPNJ-UHFFFAOYSA-N
MW261.37 g/mol
LogP1.46
Rot. Bonds3

About 1-[1-(5-propan-2-yl-2-pyridinyl)pyrrolidin-3-yl]azetidin-3-ol

1-[1-(5-propan-2-yl-2-pyridinyl)pyrrolidin-3-yl]azetidin-3-ol (PubChem CID 163566673) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is 1-[1-(5-propan-2-yl-2-pyridinyl)pyrrolidin-3-yl]azetidin-3-ol.

Molecular Properties

Compound Name1-[1-(5-propan-2-yl-2-pyridinyl)pyrrolidin-3-yl]azetidin-3-ol
PubChem CID163566673
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name1-[1-(5-propan-2-yl-2-pyridinyl)pyrrolidin-3-yl]azetidin-3-ol
SMILESCC(C)c1ccc(N2CCC(N3CC(O)C3)C2)nc1
InChIInChI=1S/C15H23N3O/c1-11(2)12-3-4-15(16-7-12)17-6-5-13(8-17)18-9-14(19)10-18/h3-4,7,11,13-14,19H,5-6,8-10H2,1-2H3
InChIKeyFVUSFOMHAPEPNJ-UHFFFAOYSA-N
XLogP1.46
TPSA39.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(3S)-3-methylpyrrolidin-1-yl]-5-propan-2-ylpyridine
CID 121288951
1-(5-propan-2-yl-2-pyridinyl)pyrrolidin-3-amine
CID 59410271
1-[1-[5-[(1R)-1-hydroxyethyl]-2-pyridinyl]pyrrolidin-3-yl]ethanol
CID 103942856
2-[1-(5-propan-2-yl-2-pyridinyl)piperidin-4-yl]ethanamine
CID 141263787
(1S)-1-[6-[3-(trifluoromethyl)pyrrolidin-1-yl]-3-pyridinyl]ethanol
CID 114271915
5-propan-2-yl-2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]pyridine
CID 143718986
4-(5-propan-2-yl-2-pyridinyl)morpholine
CID 20750181
1-[1-(5-propan-2-yl-2-pyridinyl)azetidin-3-yl]-1,3-diazinane-2,4-dione
CID 171799931
5-(5-propan-2-yl-2-pyridinyl)-8-oxa-2,5-diazabicyclo[5.1.0]octane
CID 155198546
3-methyl-1-(5-propan-2-yl-2-pyridinyl)azetidin-3-ol
CID 176651247
5-propan-2-yl-2-(3-prop-1-en-2-yloxyazetidin-1-yl)pyridine
CID 90991499
5-propan-2-yl-2-[4-[2-[(3R)-1-propan-2-ylpiperidin-3-yl]ethyl]piperidin-1-yl]pyridine
CID 176934902

Frequently Asked Questions

What is the IUPAC name of 1-[1-(5-propan-2-yl-2-pyridinyl)pyrrolidin-3-yl]azetidin-3-ol?
The IUPAC name of 1-[1-(5-propan-2-yl-2-pyridinyl)pyrrolidin-3-yl]azetidin-3-ol (CID 163566673) is 1-[1-(5-propan-2-yl-2-pyridinyl)pyrrolidin-3-yl]azetidin-3-ol.
What is the SMILES notation for 1-[1-(5-propan-2-yl-2-pyridinyl)pyrrolidin-3-yl]azetidin-3-ol?
The canonical SMILES for 1-[1-(5-propan-2-yl-2-pyridinyl)pyrrolidin-3-yl]azetidin-3-ol is CC(C)c1ccc(N2CCC(N3CC(O)C3)C2)nc1.
What is the InChIKey of 1-[1-(5-propan-2-yl-2-pyridinyl)pyrrolidin-3-yl]azetidin-3-ol?
The InChIKey is FVUSFOMHAPEPNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-11(2)12-3-4-15(16-7-12)17-6-5-13(8-17)18-9-14(19)10-18/h3-4,7,11,13-14,19H,5-6,8-10H2,1-2H3.
What are the key properties of 1-[1-(5-propan-2-yl-2-pyridinyl)pyrrolidin-3-yl]azetidin-3-ol?
1-[1-(5-propan-2-yl-2-pyridinyl)pyrrolidin-3-yl]azetidin-3-ol has a molecular weight of 261.37 g/mol, XLogP of 1.46, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(5-propan-2-yl-2-pyridinyl)pyrrolidin-3-yl]azetidin-3-ol is sourced from PubChem (CID 163566673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).