[3-(methylamino)piperidin-1-yl]-(2-methyl-6-phenyl-3-pyridinyl)methanone

C19H23N3O — CID 119490331

IUPAC[3-(methylamino)piperidin-1-yl]-(2-methyl-6-phenyl-3-pyridinyl)methanone
SMILESCNC1CCCN(C(=O)c2ccc(-c3ccccc3)nc2C)C1
InChIInChI=1S/C19H23N3O/c1-14-17(19(23)22-12-6-9-16(13-22)20-2)10-11-18(21-14)15-7-4-3-5-8-15/h3-5,7-8,10-11,16,20H,6,9,12-13H2,1-2H3
InChIKeyKWTAHLBHZVZNCU-UHFFFAOYSA-N
MW309.41 g/mol
LogP2.88
Rot. Bonds3

About [3-(methylamino)piperidin-1-yl]-(2-methyl-6-phenyl-3-pyridinyl)methanone

[3-(methylamino)piperidin-1-yl]-(2-methyl-6-phenyl-3-pyridinyl)methanone (PubChem CID 119490331) has the molecular formula C19H23N3O and a molecular weight of 309.41 g/mol. Its IUPAC name is [3-(methylamino)piperidin-1-yl]-(2-methyl-6-phenyl-3-pyridinyl)methanone.

Molecular Properties

Compound Name[3-(methylamino)piperidin-1-yl]-(2-methyl-6-phenyl-3-pyridinyl)methanone
PubChem CID119490331
Molecular FormulaC19H23N3O
Molecular Weight309.41 g/mol
Exact Mass309.18
IUPAC Name[3-(methylamino)piperidin-1-yl]-(2-methyl-6-phenyl-3-pyridinyl)methanone
SMILESCNC1CCCN(C(=O)c2ccc(-c3ccccc3)nc2C)C1
InChIInChI=1S/C19H23N3O/c1-14-17(19(23)22-12-6-9-16(13-22)20-2)10-11-18(21-14)15-7-4-3-5-8-15/h3-5,7-8,10-11,16,20H,6,9,12-13H2,1-2H3
InChIKeyKWTAHLBHZVZNCU-UHFFFAOYSA-N
XLogP2.88
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.41
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3-hydroxypiperidin-1-yl)-(2-methyl-6-phenyl-3-pyridinyl)methanone
CID 110883825
[3-(1-aminoethyl)piperidin-1-yl]-(2-methyl-6-phenyl-3-pyridinyl)methanone
CID 119594584
(3-aminopiperidin-1-yl)-(2-methyl-6-phenyl-3-pyridinyl)methanone;dihydrochloride
CID 119379268
[2-methyl-6-(4-methylphenyl)-3-pyridinyl]-[(3S)-3-methylpiperidin-1-yl]methanone
CID 124938243
(4-hydroxypiperidin-1-yl)-(2-methyl-6-phenyl-3-pyridinyl)methanone
CID 110883923
[3-(methylamino)piperidin-1-yl]-(2-methylquinolin-3-yl)methanone;dihydrochloride
CID 126772613
(4-cyclopentylpiperazin-1-yl)-(2-methyl-6-phenyl-3-pyridinyl)methanone
CID 55584701
[6-(4-fluorophenyl)-2-methyl-3-pyridinyl]-[(3R)-3-methylpiperidin-1-yl]methanone
CID 124938472
(2,6-dimethyl-3-pyridinyl)-[3-(methylamino)pyrrolidin-1-yl]methanone
CID 81466183
3-[3-(methylamino)piperidine-1-carbonyl]-6-phenyl-1H-pyridin-2-one
CID 119491224
[4-(1-aminoethyl)piperidin-1-yl]-(2-methyl-6-phenyl-3-pyridinyl)methanone
CID 119518663
N-cyclohexyl-2-methyl-6-phenylpyridine-3-carboxamide
CID 3410229

Frequently Asked Questions

What is the IUPAC name of [3-(methylamino)piperidin-1-yl]-(2-methyl-6-phenyl-3-pyridinyl)methanone?
The IUPAC name of [3-(methylamino)piperidin-1-yl]-(2-methyl-6-phenyl-3-pyridinyl)methanone (CID 119490331) is [3-(methylamino)piperidin-1-yl]-(2-methyl-6-phenyl-3-pyridinyl)methanone.
What is the SMILES notation for [3-(methylamino)piperidin-1-yl]-(2-methyl-6-phenyl-3-pyridinyl)methanone?
The canonical SMILES for [3-(methylamino)piperidin-1-yl]-(2-methyl-6-phenyl-3-pyridinyl)methanone is CNC1CCCN(C(=O)c2ccc(-c3ccccc3)nc2C)C1.
What is the InChIKey of [3-(methylamino)piperidin-1-yl]-(2-methyl-6-phenyl-3-pyridinyl)methanone?
The InChIKey is KWTAHLBHZVZNCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O/c1-14-17(19(23)22-12-6-9-16(13-22)20-2)10-11-18(21-14)15-7-4-3-5-8-15/h3-5,7-8,10-11,16,20H,6,9,12-13H2,1-2H3.
What are the key properties of [3-(methylamino)piperidin-1-yl]-(2-methyl-6-phenyl-3-pyridinyl)methanone?
[3-(methylamino)piperidin-1-yl]-(2-methyl-6-phenyl-3-pyridinyl)methanone has a molecular weight of 309.41 g/mol, XLogP of 2.88, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(methylamino)piperidin-1-yl]-(2-methyl-6-phenyl-3-pyridinyl)methanone is sourced from PubChem (CID 119490331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).