N-[3-[[5-(3-methylpiperidine-1-carbonyl)-2-pyridinyl]amino]phenyl]acetamide

C20H24N4O2 — CID 109161758

IUPACN-[3-[[5-(3-methylpiperidine-1-carbonyl)-2-pyridinyl]amino]phenyl]acetamide
SMILESCC(=O)Nc1cccc(Nc2ccc(C(=O)N3CCCC(C)C3)cn2)c1
InChIInChI=1S/C20H24N4O2/c1-14-5-4-10-24(13-14)20(26)16-8-9-19(21-12-16)23-18-7-3-6-17(11-18)22-15(2)25/h3,6-9,11-12,14H,4-5,10,13H2,1-2H3,(H,21,23)(H,22,25)
InChIKeyLKAGJEKZGMQVAA-UHFFFAOYSA-N
MW352.44 g/mol
LogP3.66
Rot. Bonds4

About N-[3-[[5-(3-methylpiperidine-1-carbonyl)-2-pyridinyl]amino]phenyl]acetamide

N-[3-[[5-(3-methylpiperidine-1-carbonyl)-2-pyridinyl]amino]phenyl]acetamide (PubChem CID 109161758) has the molecular formula C20H24N4O2 and a molecular weight of 352.44 g/mol. Its IUPAC name is N-[3-[[5-(3-methylpiperidine-1-carbonyl)-2-pyridinyl]amino]phenyl]acetamide.

Molecular Properties

Compound NameN-[3-[[5-(3-methylpiperidine-1-carbonyl)-2-pyridinyl]amino]phenyl]acetamide
PubChem CID109161758
Molecular FormulaC20H24N4O2
Molecular Weight352.44 g/mol
Exact Mass352.19
IUPAC NameN-[3-[[5-(3-methylpiperidine-1-carbonyl)-2-pyridinyl]amino]phenyl]acetamide
SMILESCC(=O)Nc1cccc(Nc2ccc(C(=O)N3CCCC(C)C3)cn2)c1
InChIInChI=1S/C20H24N4O2/c1-14-5-4-10-24(13-14)20(26)16-8-9-19(21-12-16)23-18-7-3-6-17(11-18)22-15(2)25/h3,6-9,11-12,14H,4-5,10,13H2,1-2H3,(H,21,23)(H,22,25)
InChIKeyLKAGJEKZGMQVAA-UHFFFAOYSA-N
XLogP3.66
TPSA74.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.44
LogP ≤ 53.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(6-anilino-3-pyridinyl)-(3-methylpiperidin-1-yl)methanone
CID 23725328
N-[3-[[5-(4-formylpiperazine-1-carbonyl)-2-pyridinyl]amino]phenyl]acetamide
CID 109155045
[6-(2-tert-butylanilino)-3-pyridinyl]-(3-methylpiperidin-1-yl)methanone
CID 109161744
6-(3-acetamidoanilino)-N-cycloheptylpyridine-3-carboxamide
CID 109161071
[2-(3-fluoroanilino)pyrimidin-5-yl]-(3-methylpiperidin-1-yl)methanone
CID 109264391
N-[3-(3-methylpiperidine-1-carbonyl)phenyl]cyclopropanecarboxamide
CID 51149495
N-(3-chlorophenyl)-5-(3-methylpiperidine-1-carbonyl)pyridine-3-carboxamide
CID 109107515
N-(3-acetamidophenyl)-2-(3-methylpiperidin-1-yl)pyridine-4-carboxamide
CID 109175784
(6-hydrazinyl-3-pyridinyl)-(3-methylpyrrolidin-1-yl)methanone
CID 62237527
(3-methylpiperidin-1-yl)-(6-phenyl-3-pyridinyl)methanone
CID 110683661
6-(3-acetamidoanilino)-N-(3-methylphenyl)pyridine-3-carboxamide
CID 109162236
(3-methylpiperidin-1-yl)-[5-[3-(trifluoromethyl)anilino]-3-pyridinyl]methanone
CID 109240749

Frequently Asked Questions

What is the IUPAC name of N-[3-[[5-(3-methylpiperidine-1-carbonyl)-2-pyridinyl]amino]phenyl]acetamide?
The IUPAC name of N-[3-[[5-(3-methylpiperidine-1-carbonyl)-2-pyridinyl]amino]phenyl]acetamide (CID 109161758) is N-[3-[[5-(3-methylpiperidine-1-carbonyl)-2-pyridinyl]amino]phenyl]acetamide.
What is the SMILES notation for N-[3-[[5-(3-methylpiperidine-1-carbonyl)-2-pyridinyl]amino]phenyl]acetamide?
The canonical SMILES for N-[3-[[5-(3-methylpiperidine-1-carbonyl)-2-pyridinyl]amino]phenyl]acetamide is CC(=O)Nc1cccc(Nc2ccc(C(=O)N3CCCC(C)C3)cn2)c1.
What is the InChIKey of N-[3-[[5-(3-methylpiperidine-1-carbonyl)-2-pyridinyl]amino]phenyl]acetamide?
The InChIKey is LKAGJEKZGMQVAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N4O2/c1-14-5-4-10-24(13-14)20(26)16-8-9-19(21-12-16)23-18-7-3-6-17(11-18)22-15(2)25/h3,6-9,11-12,14H,4-5,10,13H2,1-2H3,(H,21,23)(H,22,25).
What are the key properties of N-[3-[[5-(3-methylpiperidine-1-carbonyl)-2-pyridinyl]amino]phenyl]acetamide?
N-[3-[[5-(3-methylpiperidine-1-carbonyl)-2-pyridinyl]amino]phenyl]acetamide has a molecular weight of 352.44 g/mol, XLogP of 3.66, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[[5-(3-methylpiperidine-1-carbonyl)-2-pyridinyl]amino]phenyl]acetamide is sourced from PubChem (CID 109161758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).