[(3R)-3-(5-methyl-1H-imidazol-2-yl)piperidin-1-yl]-quinolin-2-ylmethanone

C19H20N4O — CID 124942397

IUPAC[(3R)-3-(5-methyl-1H-imidazol-2-yl)piperidin-1-yl]-quinolin-2-ylmethanone
SMILESCc1cnc([C@@H]2CCCN(C(=O)c3ccc4ccccc4n3)C2)[nH]1
InChIInChI=1S/C19H20N4O/c1-13-11-20-18(21-13)15-6-4-10-23(12-15)19(24)17-9-8-14-5-2-3-7-16(14)22-17/h2-3,5,7-9,11,15H,4,6,10,12H2,1H3,(H,20,21)/t15-/m1/s1
InChIKeyAUPSCBHPNAFFKX-OAHLLOKOSA-N
MW320.40 g/mol
LogP3.29
Rot. Bonds2

About [(3R)-3-(5-methyl-1H-imidazol-2-yl)piperidin-1-yl]-quinolin-2-ylmethanone

[(3R)-3-(5-methyl-1H-imidazol-2-yl)piperidin-1-yl]-quinolin-2-ylmethanone (PubChem CID 124942397) has the molecular formula C19H20N4O and a molecular weight of 320.40 g/mol. Its IUPAC name is [(3R)-3-(5-methyl-1H-imidazol-2-yl)piperidin-1-yl]-quinolin-2-ylmethanone.

Molecular Properties

Compound Name[(3R)-3-(5-methyl-1H-imidazol-2-yl)piperidin-1-yl]-quinolin-2-ylmethanone
PubChem CID124942397
Molecular FormulaC19H20N4O
Molecular Weight320.40 g/mol
Exact Mass320.16
IUPAC Name[(3R)-3-(5-methyl-1H-imidazol-2-yl)piperidin-1-yl]-quinolin-2-ylmethanone
SMILESCc1cnc([C@@H]2CCCN(C(=O)c3ccc4ccccc4n3)C2)[nH]1
InChIInChI=1S/C19H20N4O/c1-13-11-20-18(21-13)15-6-4-10-23(12-15)19(24)17-9-8-14-5-2-3-7-16(14)22-17/h2-3,5,7-9,11,15H,4,6,10,12H2,1H3,(H,20,21)/t15-/m1/s1
InChIKeyAUPSCBHPNAFFKX-OAHLLOKOSA-N
XLogP3.29
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.40
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [(3R)-3-(5-methyl-1H-imidazol-2-yl)piperidin-1-yl]-quinolin-2-ylmethanone with MolForge

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Related Compounds

[(3R)-3-(5-methyl-1H-imidazol-2-yl)piperidin-1-yl]-(1,3-thiazol-4-yl)methanone
CID 125012156
[(3S)-3-(5-methyl-1H-imidazol-2-yl)piperidin-1-yl]-(1,3-thiazol-4-yl)methanone
CID 125012155
(2-chlorophenyl)-[(3R)-3-(5-methyl-1H-imidazol-2-yl)piperidin-1-yl]methanone
CID 124949617
[(3S)-3-(5-methyl-1H-imidazol-2-yl)piperidin-1-yl]-quinolin-6-ylmethanone
CID 124986274
(3-methyl-1-benzofuran-2-yl)-[(3R)-3-(5-methyl-1H-imidazol-2-yl)piperidin-1-yl]methanone
CID 124970480
(3-pyrazin-2-ylpiperidin-1-yl)-quinolin-2-ylmethanone
CID 127246090
[3-(4-methyl-1H-pyrazol-5-yl)pyrrolidin-1-yl]-quinolin-2-ylmethanone
CID 127247164
[(3R)-3-pyrazin-2-ylpiperidin-1-yl]-quinolin-2-ylmethanone
CID 124964601
1-[3-(5-methyl-1H-imidazol-2-yl)piperidin-1-yl]-2-naphthalen-2-ylethanone
CID 110104199
(3-phenylazepan-1-yl)-quinolin-2-ylmethanone
CID 90608386
[(3R)-3-aminopiperidin-1-yl]-quinolin-2-ylmethanone
CID 102978482
1-(quinoline-2-carbonyl)piperidine-3-carboxylic acid
CID 16792484

Frequently Asked Questions

What is the IUPAC name of [(3R)-3-(5-methyl-1H-imidazol-2-yl)piperidin-1-yl]-quinolin-2-ylmethanone?
The IUPAC name of [(3R)-3-(5-methyl-1H-imidazol-2-yl)piperidin-1-yl]-quinolin-2-ylmethanone (CID 124942397) is [(3R)-3-(5-methyl-1H-imidazol-2-yl)piperidin-1-yl]-quinolin-2-ylmethanone.
What is the SMILES notation for [(3R)-3-(5-methyl-1H-imidazol-2-yl)piperidin-1-yl]-quinolin-2-ylmethanone?
The canonical SMILES for [(3R)-3-(5-methyl-1H-imidazol-2-yl)piperidin-1-yl]-quinolin-2-ylmethanone is Cc1cnc([C@@H]2CCCN(C(=O)c3ccc4ccccc4n3)C2)[nH]1.
What is the InChIKey of [(3R)-3-(5-methyl-1H-imidazol-2-yl)piperidin-1-yl]-quinolin-2-ylmethanone?
The InChIKey is AUPSCBHPNAFFKX-OAHLLOKOSA-N. The full InChI is InChI=1S/C19H20N4O/c1-13-11-20-18(21-13)15-6-4-10-23(12-15)19(24)17-9-8-14-5-2-3-7-16(14)22-17/h2-3,5,7-9,11,15H,4,6,10,12H2,1H3,(H,20,21)/t15-/m1/s1.
What are the key properties of [(3R)-3-(5-methyl-1H-imidazol-2-yl)piperidin-1-yl]-quinolin-2-ylmethanone?
[(3R)-3-(5-methyl-1H-imidazol-2-yl)piperidin-1-yl]-quinolin-2-ylmethanone has a molecular weight of 320.40 g/mol, XLogP of 3.29, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(3R)-3-(5-methyl-1H-imidazol-2-yl)piperidin-1-yl]-quinolin-2-ylmethanone is sourced from PubChem (CID 124942397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).