3-(3-pyrrolidin-1-ylpropyl)pyridine

C12H18N2 — CID 70096862

IUPAC3-(3-pyrrolidin-1-ylpropyl)pyridine
SMILESc1cncc(CCCN2CCCC2)c1
InChIInChI=1S/C12H18N2/c1-2-9-14(8-1)10-4-6-12-5-3-7-13-11-12/h3,5,7,11H,1-2,4,6,8-10H2
InChIKeyPVKGZTXTGJQYRH-UHFFFAOYSA-N
MW190.29 g/mol
LogP2.11
Rot. Bonds4

About 3-(3-pyrrolidin-1-ylpropyl)pyridine

3-(3-pyrrolidin-1-ylpropyl)pyridine (PubChem CID 70096862) has the molecular formula C12H18N2 and a molecular weight of 190.29 g/mol. Its IUPAC name is 3-(3-pyrrolidin-1-ylpropyl)pyridine.

Molecular Properties

Compound Name3-(3-pyrrolidin-1-ylpropyl)pyridine
PubChem CID70096862
Molecular FormulaC12H18N2
Molecular Weight190.29 g/mol
Exact Mass190.15
IUPAC Name3-(3-pyrrolidin-1-ylpropyl)pyridine
SMILESc1cncc(CCCN2CCCC2)c1
InChIInChI=1S/C12H18N2/c1-2-9-14(8-1)10-4-6-12-5-3-7-13-11-12/h3,5,7,11H,1-2,4,6,8-10H2
InChIKeyPVKGZTXTGJQYRH-UHFFFAOYSA-N
XLogP2.11
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 52.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2-pyrrolidin-1-ylethyl)pyridine
CID 23273673
N-(2-pyridin-3-ylethyl)-3-pyrrolidin-1-ylpropan-1-amine
CID 54961065
1-(3-pyridin-3-ylpropyl)piperazine;trihydrochloride
CID 86694323
1-(4-fluorophenyl)-4-(3-pyridin-3-ylpropyl)-1,4-diazepane
CID 171906407
3-[4-(2-pyridin-3-ylethyl)piperazin-1-yl]propan-1-amine
CID 55168058
3-(pyrrolidin-1-ylmethyl)pyridine;dihydrochloride
CID 119103446
3-[3-[3-[(2S)-2-methylpiperidin-1-yl]azetidin-1-yl]propyl]pyridine
CID 124749207
1-propyl-4-(2-pyridin-3-ylethyl)piperazine
CID 171561190
4-phenyl-1-(3-pyridin-3-ylpropyl)piperidine-4-carbonitrile
CID 91831464
(2S,6R)-2,6-dimethyl-4-[1-(3-pyridin-3-ylpropyl)piperidin-4-yl]morpholine
CID 91831212
9-(3-phenylpropyl)-2-(pyridin-3-ylmethyl)-2,9-diazaspiro[4.5]decane
CID 45227788
1-methyl-4-[3-[3-(pyridin-3-ylmethoxy)phenyl]propyl]piperazine
CID 170863930

Frequently Asked Questions

What is the IUPAC name of 3-(3-pyrrolidin-1-ylpropyl)pyridine?
The IUPAC name of 3-(3-pyrrolidin-1-ylpropyl)pyridine (CID 70096862) is 3-(3-pyrrolidin-1-ylpropyl)pyridine.
What is the SMILES notation for 3-(3-pyrrolidin-1-ylpropyl)pyridine?
The canonical SMILES for 3-(3-pyrrolidin-1-ylpropyl)pyridine is c1cncc(CCCN2CCCC2)c1.
What is the InChIKey of 3-(3-pyrrolidin-1-ylpropyl)pyridine?
The InChIKey is PVKGZTXTGJQYRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2/c1-2-9-14(8-1)10-4-6-12-5-3-7-13-11-12/h3,5,7,11H,1-2,4,6,8-10H2.
What are the key properties of 3-(3-pyrrolidin-1-ylpropyl)pyridine?
3-(3-pyrrolidin-1-ylpropyl)pyridine has a molecular weight of 190.29 g/mol, XLogP of 2.11, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-pyrrolidin-1-ylpropyl)pyridine is sourced from PubChem (CID 70096862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).