4-(1-propylpyrrolidin-3-yl)piperidine

C12H24N2 — CID 117022732

IUPAC4-(1-propylpyrrolidin-3-yl)piperidine
SMILESCCCN1CCC(C2CCNCC2)C1
InChIInChI=1S/C12H24N2/c1-2-8-14-9-5-12(10-14)11-3-6-13-7-4-11/h11-13H,2-10H2,1H3
InChIKeyYOBFLIBZWYKEBF-UHFFFAOYSA-N
MW196.34 g/mol
LogP1.72
Rot. Bonds3

About 4-(1-propylpyrrolidin-3-yl)piperidine

4-(1-propylpyrrolidin-3-yl)piperidine (PubChem CID 117022732) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is 4-(1-propylpyrrolidin-3-yl)piperidine.

Molecular Properties

Compound Name4-(1-propylpyrrolidin-3-yl)piperidine
PubChem CID117022732
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC Name4-(1-propylpyrrolidin-3-yl)piperidine
SMILESCCCN1CCC(C2CCNCC2)C1
InChIInChI=1S/C12H24N2/c1-2-8-14-9-5-12(10-14)11-3-6-13-7-4-11/h11-13H,2-10H2,1H3
InChIKeyYOBFLIBZWYKEBF-UHFFFAOYSA-N
XLogP1.72
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-propyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline
CID 58878293
2-butyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline
CID 67672486
1-(2-fluoroethyl)-4-piperidin-4-ylpiperidine
CID 174296448
4-[(3-cyclopropylpyrrolidin-1-yl)methyl]piperidine;hydrochloride
CID 120849683
4-[(3R)-1-[(4-chlorophenyl)methyl]pyrrolidin-3-yl]piperidine
CID 95557007
ethane;1-methyl-4-(1-propylpiperidin-4-yl)piperidine
CID 156885500
1-ethyl-4-[(4-piperidin-4-ylpiperidin-1-yl)methyl]piperidine
CID 167091278
4-(1-butan-2-ylpyrrolidin-3-yl)piperidine;ethane
CID 170578445
2-methyl-5-propyl-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole
CID 121185272
6-(2,2-dimethylpropyl)-2,3,4,4a,5,7,8,8a-octahydro-1H-2,6-naphthyridine;ethane
CID 166478789
(3aR,7aS)-5-ethyl-2-methyl-3,3a,4,6,7,7a-hexahydro-1H-pyrrolo[3,4-c]pyridine
CID 177154446
1-(1-propylpyrrolidin-3-yl)ethanamine
CID 83981022

Frequently Asked Questions

What is the IUPAC name of 4-(1-propylpyrrolidin-3-yl)piperidine?
The IUPAC name of 4-(1-propylpyrrolidin-3-yl)piperidine (CID 117022732) is 4-(1-propylpyrrolidin-3-yl)piperidine.
What is the SMILES notation for 4-(1-propylpyrrolidin-3-yl)piperidine?
The canonical SMILES for 4-(1-propylpyrrolidin-3-yl)piperidine is CCCN1CCC(C2CCNCC2)C1.
What is the InChIKey of 4-(1-propylpyrrolidin-3-yl)piperidine?
The InChIKey is YOBFLIBZWYKEBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2/c1-2-8-14-9-5-12(10-14)11-3-6-13-7-4-11/h11-13H,2-10H2,1H3.
What are the key properties of 4-(1-propylpyrrolidin-3-yl)piperidine?
4-(1-propylpyrrolidin-3-yl)piperidine has a molecular weight of 196.34 g/mol, XLogP of 1.72, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-propylpyrrolidin-3-yl)piperidine is sourced from PubChem (CID 117022732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).