1-(2-methylpropanoyl)-N-(3-methyl-2-pyridinyl)piperidine-4-carboxamide

C16H23N3O2 — CID 32699714

IUPAC1-(2-methylpropanoyl)-N-(3-methyl-2-pyridinyl)piperidine-4-carboxamide
SMILESCc1cccnc1NC(=O)C1CCN(C(=O)C(C)C)CC1
InChIInChI=1S/C16H23N3O2/c1-11(2)16(21)19-9-6-13(7-10-19)15(20)18-14-12(3)5-4-8-17-14/h4-5,8,11,13H,6-7,9-10H2,1-3H3,(H,17,18,20)
InChIKeyIAZJBQNZWPKSBK-UHFFFAOYSA-N
MW289.38 g/mol
LogP2.22
Rot. Bonds3

About 1-(2-methylpropanoyl)-N-(3-methyl-2-pyridinyl)piperidine-4-carboxamide

1-(2-methylpropanoyl)-N-(3-methyl-2-pyridinyl)piperidine-4-carboxamide (PubChem CID 32699714) has the molecular formula C16H23N3O2 and a molecular weight of 289.38 g/mol. Its IUPAC name is 1-(2-methylpropanoyl)-N-(3-methyl-2-pyridinyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(2-methylpropanoyl)-N-(3-methyl-2-pyridinyl)piperidine-4-carboxamide
PubChem CID32699714
Molecular FormulaC16H23N3O2
Molecular Weight289.38 g/mol
Exact Mass289.18
IUPAC Name1-(2-methylpropanoyl)-N-(3-methyl-2-pyridinyl)piperidine-4-carboxamide
SMILESCc1cccnc1NC(=O)C1CCN(C(=O)C(C)C)CC1
InChIInChI=1S/C16H23N3O2/c1-11(2)16(21)19-9-6-13(7-10-19)15(20)18-14-12(3)5-4-8-17-14/h4-5,8,11,13H,6-7,9-10H2,1-3H3,(H,17,18,20)
InChIKeyIAZJBQNZWPKSBK-UHFFFAOYSA-N
XLogP2.22
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methylpropanoyl)-N-(3-methyl-2-pyridinyl)piperidine-4-carboxamide?
The IUPAC name of 1-(2-methylpropanoyl)-N-(3-methyl-2-pyridinyl)piperidine-4-carboxamide (CID 32699714) is 1-(2-methylpropanoyl)-N-(3-methyl-2-pyridinyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(2-methylpropanoyl)-N-(3-methyl-2-pyridinyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(2-methylpropanoyl)-N-(3-methyl-2-pyridinyl)piperidine-4-carboxamide is Cc1cccnc1NC(=O)C1CCN(C(=O)C(C)C)CC1.
What is the InChIKey of 1-(2-methylpropanoyl)-N-(3-methyl-2-pyridinyl)piperidine-4-carboxamide?
The InChIKey is IAZJBQNZWPKSBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O2/c1-11(2)16(21)19-9-6-13(7-10-19)15(20)18-14-12(3)5-4-8-17-14/h4-5,8,11,13H,6-7,9-10H2,1-3H3,(H,17,18,20).
What are the key properties of 1-(2-methylpropanoyl)-N-(3-methyl-2-pyridinyl)piperidine-4-carboxamide?
1-(2-methylpropanoyl)-N-(3-methyl-2-pyridinyl)piperidine-4-carboxamide has a molecular weight of 289.38 g/mol, XLogP of 2.22, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylpropanoyl)-N-(3-methyl-2-pyridinyl)piperidine-4-carboxamide is sourced from PubChem (CID 32699714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).