(8-piperidin-1-ylquinolin-5-yl)urea

C15H18N4O — CID 167992902

IUPAC(8-piperidin-1-ylquinolin-5-yl)urea
SMILESNC(=O)Nc1ccc(N2CCCCC2)c2ncccc12
InChIInChI=1S/C15H18N4O/c16-15(20)18-12-6-7-13(19-9-2-1-3-10-19)14-11(12)5-4-8-17-14/h4-8H,1-3,9-10H2,(H3,16,18,20)
InChIKeyATWMXHLKCIUQHQ-UHFFFAOYSA-N
MW270.34 g/mol
LogP2.72
Rot. Bonds2

About (8-piperidin-1-ylquinolin-5-yl)urea

(8-piperidin-1-ylquinolin-5-yl)urea (PubChem CID 167992902) has the molecular formula C15H18N4O and a molecular weight of 270.34 g/mol. Its IUPAC name is (8-piperidin-1-ylquinolin-5-yl)urea.

Molecular Properties

Compound Name(8-piperidin-1-ylquinolin-5-yl)urea
PubChem CID167992902
Molecular FormulaC15H18N4O
Molecular Weight270.34 g/mol
Exact Mass270.15
IUPAC Name(8-piperidin-1-ylquinolin-5-yl)urea
SMILESNC(=O)Nc1ccc(N2CCCCC2)c2ncccc12
InChIInChI=1S/C15H18N4O/c16-15(20)18-12-6-7-13(19-9-2-1-3-10-19)14-11(12)5-4-8-17-14/h4-8H,1-3,9-10H2,(H3,16,18,20)
InChIKeyATWMXHLKCIUQHQ-UHFFFAOYSA-N
XLogP2.72
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 52.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-cyano-N-(8-pyrrolidin-1-ylquinolin-5-yl)acetamide
CID 168521739
2-methyl-N-(8-pyrrolidin-1-ylquinolin-5-yl)pyrazole-3-carboxamide
CID 131909202
2-(2-methylimidazol-1-yl)-N-(8-pyrrolidin-1-ylquinolin-5-yl)acetamide
CID 131896819
(2S)-1-methylsulfonyl-N-(8-pyrrolidin-1-ylquinolin-5-yl)pyrrolidine-2-carboxamide
CID 131914481
3-(2-oxopyrrolidin-1-yl)-N-(8-pyrrolidin-1-ylquinolin-5-yl)propanamide
CID 131927592
2-[methyl(pyridin-4-ylmethyl)amino]-N-(8-pyrrolidin-1-ylquinolin-5-yl)acetamide
CID 131898446
5-oxo-1-prop-2-enyl-N-(8-pyrrolidin-1-ylquinolin-5-yl)pyrrolidine-3-carboxamide
CID 131943338
N-(8-pyrrolidin-1-ylquinolin-5-yl)-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine-4-carboxamide
CID 131908303
2-(4-oxothieno[3,2-d]pyrimidin-3-yl)-N-(8-pyrrolidin-1-ylquinolin-5-yl)acetamide
CID 131951504
5-nitro-8-piperidin-1-ylquinoline
CID 3124100
10-pyrrolidin-1-yl-13-(10-pyrrolidin-1-ylquinoxalino[3,2-f][1,10]phenanthrolin-13-yl)quinoxalino[2,3-f][1,10]phenanthroline
CID 101228052
N-(5-chloroquinolin-8-yl)piperidine-1-carboxamide
CID 116783798

Frequently Asked Questions

What is the IUPAC name of (8-piperidin-1-ylquinolin-5-yl)urea?
The IUPAC name of (8-piperidin-1-ylquinolin-5-yl)urea (CID 167992902) is (8-piperidin-1-ylquinolin-5-yl)urea.
What is the SMILES notation for (8-piperidin-1-ylquinolin-5-yl)urea?
The canonical SMILES for (8-piperidin-1-ylquinolin-5-yl)urea is NC(=O)Nc1ccc(N2CCCCC2)c2ncccc12.
What is the InChIKey of (8-piperidin-1-ylquinolin-5-yl)urea?
The InChIKey is ATWMXHLKCIUQHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O/c16-15(20)18-12-6-7-13(19-9-2-1-3-10-19)14-11(12)5-4-8-17-14/h4-8H,1-3,9-10H2,(H3,16,18,20).
What are the key properties of (8-piperidin-1-ylquinolin-5-yl)urea?
(8-piperidin-1-ylquinolin-5-yl)urea has a molecular weight of 270.34 g/mol, XLogP of 2.72, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (8-piperidin-1-ylquinolin-5-yl)urea is sourced from PubChem (CID 167992902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).