2-(4-methylpiperidin-1-yl)-N-(4-methyl-3-pyridinyl)acetamide

C14H21N3O — CID 156906798

IUPAC2-(4-methylpiperidin-1-yl)-N-(4-methyl-3-pyridinyl)acetamide
SMILESCc1ccncc1NC(=O)CN1CCC(C)CC1
InChIInChI=1S/C14H21N3O/c1-11-4-7-17(8-5-11)10-14(18)16-13-9-15-6-3-12(13)2/h3,6,9,11H,4-5,7-8,10H2,1-2H3,(H,16,18)
InChIKeyBZNRCHXVMKBNNF-UHFFFAOYSA-N
MW247.34 g/mol
LogP2.06
Rot. Bonds3

About 2-(4-methylpiperidin-1-yl)-N-(4-methyl-3-pyridinyl)acetamide

2-(4-methylpiperidin-1-yl)-N-(4-methyl-3-pyridinyl)acetamide (PubChem CID 156906798) has the molecular formula C14H21N3O and a molecular weight of 247.34 g/mol. Its IUPAC name is 2-(4-methylpiperidin-1-yl)-N-(4-methyl-3-pyridinyl)acetamide.

Molecular Properties

Compound Name2-(4-methylpiperidin-1-yl)-N-(4-methyl-3-pyridinyl)acetamide
PubChem CID156906798
Molecular FormulaC14H21N3O
Molecular Weight247.34 g/mol
Exact Mass247.17
IUPAC Name2-(4-methylpiperidin-1-yl)-N-(4-methyl-3-pyridinyl)acetamide
SMILESCc1ccncc1NC(=O)CN1CCC(C)CC1
InChIInChI=1S/C14H21N3O/c1-11-4-7-17(8-5-11)10-14(18)16-13-9-15-6-3-12(13)2/h3,6,9,11H,4-5,7-8,10H2,1-2H3,(H,16,18)
InChIKeyBZNRCHXVMKBNNF-UHFFFAOYSA-N
XLogP2.06
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methylpiperidin-1-yl)-N-(4-methyl-3-pyridinyl)acetamide?
The IUPAC name of 2-(4-methylpiperidin-1-yl)-N-(4-methyl-3-pyridinyl)acetamide (CID 156906798) is 2-(4-methylpiperidin-1-yl)-N-(4-methyl-3-pyridinyl)acetamide.
What is the SMILES notation for 2-(4-methylpiperidin-1-yl)-N-(4-methyl-3-pyridinyl)acetamide?
The canonical SMILES for 2-(4-methylpiperidin-1-yl)-N-(4-methyl-3-pyridinyl)acetamide is Cc1ccncc1NC(=O)CN1CCC(C)CC1.
What is the InChIKey of 2-(4-methylpiperidin-1-yl)-N-(4-methyl-3-pyridinyl)acetamide?
The InChIKey is BZNRCHXVMKBNNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O/c1-11-4-7-17(8-5-11)10-14(18)16-13-9-15-6-3-12(13)2/h3,6,9,11H,4-5,7-8,10H2,1-2H3,(H,16,18).
What are the key properties of 2-(4-methylpiperidin-1-yl)-N-(4-methyl-3-pyridinyl)acetamide?
2-(4-methylpiperidin-1-yl)-N-(4-methyl-3-pyridinyl)acetamide has a molecular weight of 247.34 g/mol, XLogP of 2.06, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylpiperidin-1-yl)-N-(4-methyl-3-pyridinyl)acetamide is sourced from PubChem (CID 156906798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).