5-(2-methylpropyl)-2-pyrrolidin-1-ylpyridine

C13H20N2 — CID 59000961

IUPAC5-(2-methylpropyl)-2-pyrrolidin-1-ylpyridine
SMILESCC(C)Cc1ccc(N2CCCC2)nc1
InChIInChI=1S/C13H20N2/c1-11(2)9-12-5-6-13(14-10-12)15-7-3-4-8-15/h5-6,10-11H,3-4,7-9H2,1-2H3
InChIKeyCJXMPTJNJKRDIZ-UHFFFAOYSA-N
MW204.32 g/mol
LogP2.88
Rot. Bonds3

About 5-(2-methylpropyl)-2-pyrrolidin-1-ylpyridine

5-(2-methylpropyl)-2-pyrrolidin-1-ylpyridine (PubChem CID 59000961) has the molecular formula C13H20N2 and a molecular weight of 204.32 g/mol. Its IUPAC name is 5-(2-methylpropyl)-2-pyrrolidin-1-ylpyridine.

Molecular Properties

Compound Name5-(2-methylpropyl)-2-pyrrolidin-1-ylpyridine
PubChem CID59000961
Molecular FormulaC13H20N2
Molecular Weight204.32 g/mol
Exact Mass204.16
IUPAC Name5-(2-methylpropyl)-2-pyrrolidin-1-ylpyridine
SMILESCC(C)Cc1ccc(N2CCCC2)nc1
InChIInChI=1S/C13H20N2/c1-11(2)9-12-5-6-13(14-10-12)15-7-3-4-8-15/h5-6,10-11H,3-4,7-9H2,1-2H3
InChIKeyCJXMPTJNJKRDIZ-UHFFFAOYSA-N
XLogP2.88
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.32
LogP ≤ 52.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[6-(azocan-1-yl)-3-pyridinyl]methyl]-2-methylpropan-1-amine
CID 62279303
(2R)-1-[methyl-[(6-pyrrolidin-1-yl-3-pyridinyl)methyl]amino]propan-2-ol
CID 99629566
5-(isocyanomethyl)-2-pyrrolidin-1-ylpyridine
CID 83483400
1-(6-piperidin-1-yl-3-pyridinyl)propan-2-one
CID 83888260
2-methyl-N-[(6-pyrrolidin-1-yl-3-pyridinyl)methyl]butanamide
CID 46598711
(2R)-2-amino-N-[(6-piperidin-1-yl-3-pyridinyl)methyl]propanamide
CID 119846624
1,1-diphenyl-N-[(6-pyrrolidin-1-yl-3-pyridinyl)methyl]propan-2-amine
CID 167851736
(1S)-1-(6-piperidin-1-yl-3-pyridinyl)ethanamine
CID 79022376
1-[5-(2-aminopropyl)-2-pyridinyl]-N,N-dimethylpiperidin-4-amine
CID 80634559
2-methyl-3-(methylamino)-N-[(6-pyrrolidin-1-yl-3-pyridinyl)methyl]propanamide
CID 119399590
1-[[6-(azepan-1-yl)-3-pyridinyl]methyl]-2-methyl-3-propan-2-ylguanidine
CID 111125338
N-[(6-thiomorpholin-4-yl-3-pyridinyl)methyl]propan-2-amine
CID 62280369

Frequently Asked Questions

What is the IUPAC name of 5-(2-methylpropyl)-2-pyrrolidin-1-ylpyridine?
The IUPAC name of 5-(2-methylpropyl)-2-pyrrolidin-1-ylpyridine (CID 59000961) is 5-(2-methylpropyl)-2-pyrrolidin-1-ylpyridine.
What is the SMILES notation for 5-(2-methylpropyl)-2-pyrrolidin-1-ylpyridine?
The canonical SMILES for 5-(2-methylpropyl)-2-pyrrolidin-1-ylpyridine is CC(C)Cc1ccc(N2CCCC2)nc1.
What is the InChIKey of 5-(2-methylpropyl)-2-pyrrolidin-1-ylpyridine?
The InChIKey is CJXMPTJNJKRDIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2/c1-11(2)9-12-5-6-13(14-10-12)15-7-3-4-8-15/h5-6,10-11H,3-4,7-9H2,1-2H3.
What are the key properties of 5-(2-methylpropyl)-2-pyrrolidin-1-ylpyridine?
5-(2-methylpropyl)-2-pyrrolidin-1-ylpyridine has a molecular weight of 204.32 g/mol, XLogP of 2.88, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methylpropyl)-2-pyrrolidin-1-ylpyridine is sourced from PubChem (CID 59000961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).