N-methyl-N-(1-methylpiperidin-4-yl)-6-phenylpyridine-3-carboxamide

C19H23N3O — CID 42802995

IUPACN-methyl-N-(1-methylpiperidin-4-yl)-6-phenylpyridine-3-carboxamide
SMILESCN1CCC(N(C)C(=O)c2ccc(-c3ccccc3)nc2)CC1
InChIInChI=1S/C19H23N3O/c1-21-12-10-17(11-13-21)22(2)19(23)16-8-9-18(20-14-16)15-6-4-3-5-7-15/h3-9,14,17H,10-13H2,1-2H3
InChIKeyIWYXJNQLJNFNOR-UHFFFAOYSA-N
MW309.41 g/mol
LogP2.91
Rot. Bonds3

About N-methyl-N-(1-methylpiperidin-4-yl)-6-phenylpyridine-3-carboxamide

N-methyl-N-(1-methylpiperidin-4-yl)-6-phenylpyridine-3-carboxamide (PubChem CID 42802995) has the molecular formula C19H23N3O and a molecular weight of 309.41 g/mol. Its IUPAC name is N-methyl-N-(1-methylpiperidin-4-yl)-6-phenylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-N-(1-methylpiperidin-4-yl)-6-phenylpyridine-3-carboxamide
PubChem CID42802995
Molecular FormulaC19H23N3O
Molecular Weight309.41 g/mol
Exact Mass309.18
IUPAC NameN-methyl-N-(1-methylpiperidin-4-yl)-6-phenylpyridine-3-carboxamide
SMILESCN1CCC(N(C)C(=O)c2ccc(-c3ccccc3)nc2)CC1
InChIInChI=1S/C19H23N3O/c1-21-12-10-17(11-13-21)22(2)19(23)16-8-9-18(20-14-16)15-6-4-3-5-7-15/h3-9,14,17H,10-13H2,1-2H3
InChIKeyIWYXJNQLJNFNOR-UHFFFAOYSA-N
XLogP2.91
TPSA36.44 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.41
LogP ≤ 52.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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Phenyl-3-pyridinylmethanone
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Soticlestat
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(2,4-Dimethyl-pyridin-3-yl)-(4-methyl-4-{3-methyl-4-[1-(4-trifluoromethyl-phenyl)-ethyl]-piperazin-1-yl}-piperidin-1-yl)-methanone
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3-Acetyl-6-methylpyridine
CID 95292
Sch 350634
CID 511332
4-Phenyl-1-(pyridine-3-carbonyl)pyrrolidin-2-one
CID 3071506

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(1-methylpiperidin-4-yl)-6-phenylpyridine-3-carboxamide?
The IUPAC name of N-methyl-N-(1-methylpiperidin-4-yl)-6-phenylpyridine-3-carboxamide (CID 42802995) is N-methyl-N-(1-methylpiperidin-4-yl)-6-phenylpyridine-3-carboxamide.
What is the SMILES notation for N-methyl-N-(1-methylpiperidin-4-yl)-6-phenylpyridine-3-carboxamide?
The canonical SMILES for N-methyl-N-(1-methylpiperidin-4-yl)-6-phenylpyridine-3-carboxamide is CN1CCC(N(C)C(=O)c2ccc(-c3ccccc3)nc2)CC1.
What is the InChIKey of N-methyl-N-(1-methylpiperidin-4-yl)-6-phenylpyridine-3-carboxamide?
The InChIKey is IWYXJNQLJNFNOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O/c1-21-12-10-17(11-13-21)22(2)19(23)16-8-9-18(20-14-16)15-6-4-3-5-7-15/h3-9,14,17H,10-13H2,1-2H3.
What are the key properties of N-methyl-N-(1-methylpiperidin-4-yl)-6-phenylpyridine-3-carboxamide?
N-methyl-N-(1-methylpiperidin-4-yl)-6-phenylpyridine-3-carboxamide has a molecular weight of 309.41 g/mol, XLogP of 2.91, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(1-methylpiperidin-4-yl)-6-phenylpyridine-3-carboxamide is sourced from PubChem (CID 42802995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).