5-pyrrolidin-1-ylquinoline

C13H14N2 — CID 118731129

IUPAC5-pyrrolidin-1-ylquinoline
SMILESc1cc(N2CCCC2)c2cccnc2c1
InChIInChI=1S/C13H14N2/c1-2-10-15(9-1)13-7-3-6-12-11(13)5-4-8-14-12/h3-8H,1-2,9-10H2
InChIKeyINXCWOHZYCJTEA-UHFFFAOYSA-N
MW198.27 g/mol
LogP2.84
Rot. Bonds1

About 5-pyrrolidin-1-ylquinoline

5-pyrrolidin-1-ylquinoline (PubChem CID 118731129) has the molecular formula C13H14N2 and a molecular weight of 198.27 g/mol. Its IUPAC name is 5-pyrrolidin-1-ylquinoline.

Molecular Properties

Compound Name5-pyrrolidin-1-ylquinoline
PubChem CID118731129
Molecular FormulaC13H14N2
Molecular Weight198.27 g/mol
Exact Mass198.12
IUPAC Name5-pyrrolidin-1-ylquinoline
SMILESc1cc(N2CCCC2)c2cccnc2c1
InChIInChI=1S/C13H14N2/c1-2-10-15(9-1)13-7-3-6-12-11(13)5-4-8-14-12/h3-8H,1-2,9-10H2
InChIKeyINXCWOHZYCJTEA-UHFFFAOYSA-N
XLogP2.84
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-piperidin-1-ylquinoline
CID 12887802
5-piperazin-1-ylquinoline
CID 10656226
2-quinolin-5-yl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine
CID 79915081
5-(3,5-dimethylpiperazin-1-yl)quinoline
CID 81217174
4-(1,4-diazepan-1-yl)quinoline
CID 61339543
N-propyl-1-quinolin-5-ylpiperidin-4-amine
CID 43315003
2-quinolin-5-yl-1,3-dihydroisoindol-5-amine
CID 43370073
1-quinolin-4-ylpiperidin-4-one
CID 22000285
3-(azocan-1-yl)pyridin-2-amine
CID 104539725
ethane;methane;1-methanidyl-3-methylbenzene;5-piperazin-4-id-1-ylquinoline;tungsten;yttrium
CID 157463329
2-pyridin-2-yl-4-pyrrolidin-1-ylquinoline;hydrate
CID 51057895
1-tert-butyl-4-quinolin-5-ylpiperazine-2-carboxylic acid
CID 18414109

Frequently Asked Questions

What is the IUPAC name of 5-pyrrolidin-1-ylquinoline?
The IUPAC name of 5-pyrrolidin-1-ylquinoline (CID 118731129) is 5-pyrrolidin-1-ylquinoline.
What is the SMILES notation for 5-pyrrolidin-1-ylquinoline?
The canonical SMILES for 5-pyrrolidin-1-ylquinoline is c1cc(N2CCCC2)c2cccnc2c1.
What is the InChIKey of 5-pyrrolidin-1-ylquinoline?
The InChIKey is INXCWOHZYCJTEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2/c1-2-10-15(9-1)13-7-3-6-12-11(13)5-4-8-14-12/h3-8H,1-2,9-10H2.
What are the key properties of 5-pyrrolidin-1-ylquinoline?
5-pyrrolidin-1-ylquinoline has a molecular weight of 198.27 g/mol, XLogP of 2.84, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-pyrrolidin-1-ylquinoline is sourced from PubChem (CID 118731129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).