3-[(1R)-1-(4-pyrrolidin-1-ylpiperidin-1-yl)ethyl]pyridine

C16H25N3 — CID 95276591

IUPAC3-[(1R)-1-(4-pyrrolidin-1-ylpiperidin-1-yl)ethyl]pyridine
SMILESC[C@H](c1cccnc1)N1CCC(N2CCCC2)CC1
InChIInChI=1S/C16H25N3/c1-14(15-5-4-8-17-13-15)18-11-6-16(7-12-18)19-9-2-3-10-19/h4-5,8,13-14,16H,2-3,6-7,9-12H2,1H3/t14-/m1/s1
InChIKeySNAWOHJDNNFVST-CQSZACIVSA-N
MW259.40 g/mol
LogP2.70
Rot. Bonds3

About 3-[(1R)-1-(4-pyrrolidin-1-ylpiperidin-1-yl)ethyl]pyridine

3-[(1R)-1-(4-pyrrolidin-1-ylpiperidin-1-yl)ethyl]pyridine (PubChem CID 95276591) has the molecular formula C16H25N3 and a molecular weight of 259.40 g/mol. Its IUPAC name is 3-[(1R)-1-(4-pyrrolidin-1-ylpiperidin-1-yl)ethyl]pyridine.

Molecular Properties

Compound Name3-[(1R)-1-(4-pyrrolidin-1-ylpiperidin-1-yl)ethyl]pyridine
PubChem CID95276591
Molecular FormulaC16H25N3
Molecular Weight259.40 g/mol
Exact Mass259.20
IUPAC Name3-[(1R)-1-(4-pyrrolidin-1-ylpiperidin-1-yl)ethyl]pyridine
SMILESC[C@H](c1cccnc1)N1CCC(N2CCCC2)CC1
InChIInChI=1S/C16H25N3/c1-14(15-5-4-8-17-13-15)18-11-6-16(7-12-18)19-9-2-3-10-19/h4-5,8,13-14,16H,2-3,6-7,9-12H2,1H3/t14-/m1/s1
InChIKeySNAWOHJDNNFVST-CQSZACIVSA-N
XLogP2.70
TPSA19.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.40
LogP ≤ 52.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1-pyridin-3-ylethyl)-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine
CID 79673428
1-(1-pyridin-3-ylethyl)piperidine-4-carboxylic acid
CID 4272805
(2R)-2-[4-[(1R)-1-pyridin-3-ylethyl]piperazin-1-yl]propanoic acid
CID 124512132
4-[1-(1-phenylethyl)piperidin-4-yl]thiomorpholine
CID 171335572
3-[4-[4-(1-pyrrolidin-1-ylethyl)phenyl]phenyl]pyridine
CID 11602342
2-methyl-1-[4-(1-pyridin-3-ylethyl)piperazin-1-yl]propan-1-one
CID 87038067
[4-(1-pyridin-3-ylethyl)piperazin-1-yl]-[(2S)-pyrrolidin-2-yl]methanone;hydrochloride
CID 122081611
3-[(1S,2R)-2-pyridin-3-yl-1,2-dipyrrolidin-1-ylethyl]pyridine
CID 11163071
4-methyl-1-(1-pyridin-3-ylethyl)pyrrolidin-3-amine
CID 103575296
3-[(1S)-1-[(3S)-3-(1H-pyrazol-5-yl)piperidin-1-yl]ethyl]pyridine
CID 129370378
6-(1-pyridin-3-ylethyl)-1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridine
CID 102678299
1-propan-2-yl-N-[(1S)-1-pyridin-3-ylethyl]piperidin-4-amine
CID 28716728

Frequently Asked Questions

What is the IUPAC name of 3-[(1R)-1-(4-pyrrolidin-1-ylpiperidin-1-yl)ethyl]pyridine?
The IUPAC name of 3-[(1R)-1-(4-pyrrolidin-1-ylpiperidin-1-yl)ethyl]pyridine (CID 95276591) is 3-[(1R)-1-(4-pyrrolidin-1-ylpiperidin-1-yl)ethyl]pyridine.
What is the SMILES notation for 3-[(1R)-1-(4-pyrrolidin-1-ylpiperidin-1-yl)ethyl]pyridine?
The canonical SMILES for 3-[(1R)-1-(4-pyrrolidin-1-ylpiperidin-1-yl)ethyl]pyridine is C[C@H](c1cccnc1)N1CCC(N2CCCC2)CC1.
What is the InChIKey of 3-[(1R)-1-(4-pyrrolidin-1-ylpiperidin-1-yl)ethyl]pyridine?
The InChIKey is SNAWOHJDNNFVST-CQSZACIVSA-N. The full InChI is InChI=1S/C16H25N3/c1-14(15-5-4-8-17-13-15)18-11-6-16(7-12-18)19-9-2-3-10-19/h4-5,8,13-14,16H,2-3,6-7,9-12H2,1H3/t14-/m1/s1.
What are the key properties of 3-[(1R)-1-(4-pyrrolidin-1-ylpiperidin-1-yl)ethyl]pyridine?
3-[(1R)-1-(4-pyrrolidin-1-ylpiperidin-1-yl)ethyl]pyridine has a molecular weight of 259.40 g/mol, XLogP of 2.70, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(1R)-1-(4-pyrrolidin-1-ylpiperidin-1-yl)ethyl]pyridine is sourced from PubChem (CID 95276591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).