4-[(3R)-3-methylpiperidin-1-yl]-2-pyrrolidin-1-ylquinoline

C19H25N3 — CID 124896109

IUPAC4-[(3R)-3-methylpiperidin-1-yl]-2-pyrrolidin-1-ylquinoline
SMILESC[C@@H]1CCCN(c2cc(N3CCCC3)nc3ccccc23)C1
InChIInChI=1S/C19H25N3/c1-15-7-6-12-22(14-15)18-13-19(21-10-4-5-11-21)20-17-9-3-2-8-16(17)18/h2-3,8-9,13,15H,4-7,10-12,14H2,1H3/t15-/m1/s1
InChIKeyRJYPMPLRFDABJF-OAHLLOKOSA-N
MW295.43 g/mol
LogP4.07
Rot. Bonds2

About 4-[(3R)-3-methylpiperidin-1-yl]-2-pyrrolidin-1-ylquinoline

4-[(3R)-3-methylpiperidin-1-yl]-2-pyrrolidin-1-ylquinoline (PubChem CID 124896109) has the molecular formula C19H25N3 and a molecular weight of 295.43 g/mol. Its IUPAC name is 4-[(3R)-3-methylpiperidin-1-yl]-2-pyrrolidin-1-ylquinoline.

Molecular Properties

Compound Name4-[(3R)-3-methylpiperidin-1-yl]-2-pyrrolidin-1-ylquinoline
PubChem CID124896109
Molecular FormulaC19H25N3
Molecular Weight295.43 g/mol
Exact Mass295.20
IUPAC Name4-[(3R)-3-methylpiperidin-1-yl]-2-pyrrolidin-1-ylquinoline
SMILESC[C@@H]1CCCN(c2cc(N3CCCC3)nc3ccccc23)C1
InChIInChI=1S/C19H25N3/c1-15-7-6-12-22(14-15)18-13-19(21-10-4-5-11-21)20-17-9-3-2-8-16(17)18/h2-3,8-9,13,15H,4-7,10-12,14H2,1H3/t15-/m1/s1
InChIKeyRJYPMPLRFDABJF-OAHLLOKOSA-N
XLogP4.07
TPSA19.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.43
LogP ≤ 54.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-(chloromethyl)-2-(3-methylpiperidin-1-yl)quinoline
CID 61257807
N-methyl-1-[2-(4-methylazepan-1-yl)quinolin-4-yl]methanamine
CID 63625591
2-chloro-4-[(3S)-3-methylpiperidin-1-yl]quinazoline
CID 42149941
N-(3,3-dimethylbutan-2-yl)-2-(3-methylpiperidin-1-yl)quinoline-4-carboxamide
CID 46090939
N-[(2R)-4-methylpentan-2-yl]-2-[(3S)-3-methylpiperidin-1-yl]quinoline-4-carboxamide
CID 98638684
N-methyl-4-(3-methylpiperidin-1-yl)quinazolin-2-amine
CID 80764711
N-methyl-2-(3-methylpiperidin-1-yl)quinazolin-4-amine
CID 56699064
N-methyl-1-(2-pyrrolidin-1-ylquinolin-4-yl)methanamine
CID 62286601
2-methyl-4-[(3S)-3-methylpiperidin-1-yl]quinoline-7-carboxylic acid
CID 7138041
N-[(2-methylphenyl)methyl]-2-(3-methylpiperidin-1-yl)quinoline-4-carboxamide
CID 46090941
2-[(3R)-3-methylpiperidin-1-yl]-N-(naphthalen-1-ylmethyl)quinoline-4-carboxamide
CID 92772448
methyl 1-(2-methylquinolin-4-yl)piperidine-3-carboxylate
CID 115538397

Frequently Asked Questions

What is the IUPAC name of 4-[(3R)-3-methylpiperidin-1-yl]-2-pyrrolidin-1-ylquinoline?
The IUPAC name of 4-[(3R)-3-methylpiperidin-1-yl]-2-pyrrolidin-1-ylquinoline (CID 124896109) is 4-[(3R)-3-methylpiperidin-1-yl]-2-pyrrolidin-1-ylquinoline.
What is the SMILES notation for 4-[(3R)-3-methylpiperidin-1-yl]-2-pyrrolidin-1-ylquinoline?
The canonical SMILES for 4-[(3R)-3-methylpiperidin-1-yl]-2-pyrrolidin-1-ylquinoline is C[C@@H]1CCCN(c2cc(N3CCCC3)nc3ccccc23)C1.
What is the InChIKey of 4-[(3R)-3-methylpiperidin-1-yl]-2-pyrrolidin-1-ylquinoline?
The InChIKey is RJYPMPLRFDABJF-OAHLLOKOSA-N. The full InChI is InChI=1S/C19H25N3/c1-15-7-6-12-22(14-15)18-13-19(21-10-4-5-11-21)20-17-9-3-2-8-16(17)18/h2-3,8-9,13,15H,4-7,10-12,14H2,1H3/t15-/m1/s1.
What are the key properties of 4-[(3R)-3-methylpiperidin-1-yl]-2-pyrrolidin-1-ylquinoline?
4-[(3R)-3-methylpiperidin-1-yl]-2-pyrrolidin-1-ylquinoline has a molecular weight of 295.43 g/mol, XLogP of 4.07, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3R)-3-methylpiperidin-1-yl]-2-pyrrolidin-1-ylquinoline is sourced from PubChem (CID 124896109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).