N-methyl-N-propan-2-yl-1-(pyridine-2-carbonyl)piperidine-4-carboxamide

C16H23N3O2 — CID 86983172

IUPACN-methyl-N-propan-2-yl-1-(pyridine-2-carbonyl)piperidine-4-carboxamide
SMILESCC(C)N(C)C(=O)C1CCN(C(=O)c2ccccn2)CC1
InChIInChI=1S/C16H23N3O2/c1-12(2)18(3)15(20)13-7-10-19(11-8-13)16(21)14-6-4-5-9-17-14/h4-6,9,12-13H,7-8,10-11H2,1-3H3
InChIKeyYNDXVBCHWWVNNO-UHFFFAOYSA-N
MW289.38 g/mol
LogP1.80
Rot. Bonds3

About N-methyl-N-propan-2-yl-1-(pyridine-2-carbonyl)piperidine-4-carboxamide

N-methyl-N-propan-2-yl-1-(pyridine-2-carbonyl)piperidine-4-carboxamide (PubChem CID 86983172) has the molecular formula C16H23N3O2 and a molecular weight of 289.38 g/mol. Its IUPAC name is N-methyl-N-propan-2-yl-1-(pyridine-2-carbonyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-methyl-N-propan-2-yl-1-(pyridine-2-carbonyl)piperidine-4-carboxamide
PubChem CID86983172
Molecular FormulaC16H23N3O2
Molecular Weight289.38 g/mol
Exact Mass289.18
IUPAC NameN-methyl-N-propan-2-yl-1-(pyridine-2-carbonyl)piperidine-4-carboxamide
SMILESCC(C)N(C)C(=O)C1CCN(C(=O)c2ccccn2)CC1
InChIInChI=1S/C16H23N3O2/c1-12(2)18(3)15(20)13-7-10-19(11-8-13)16(21)14-6-4-5-9-17-14/h4-6,9,12-13H,7-8,10-11H2,1-3H3
InChIKeyYNDXVBCHWWVNNO-UHFFFAOYSA-N
XLogP1.80
TPSA53.51 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 51.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

[(4R)-4-(dimethylamino)azepan-1-yl]-pyridin-2-ylmethanone
CID 95710719
1-[4-[4-(pyridine-2-carbonyl)piperazine-1-carbonyl]piperidin-1-yl]ethanone
CID 110814030
[4-(2-methylpropylsulfonyl)piperidin-1-yl]-pyridin-2-ylmethanone
CID 90589965
(4-methylphenyl)-[1-(pyridine-2-carbonyl)piperidin-4-yl]methanone
CID 141265347
[4-(aminomethyl)piperidin-1-yl]-pyridin-2-ylmethanone
CID 21221047
[4-(2-methylphenyl)sulfanylpiperidin-1-yl]-pyridin-2-ylmethanone
CID 70757092
1-(4-cyclobutylbenzoyl)-N-methyl-N-propan-2-ylpiperidine-4-carboxamide
CID 91652591
N-methyl-N-(1-pyridin-2-ylethyl)-1-sulfamoylpiperidine-4-carboxamide
CID 146085172
2-[1-(pyridine-2-carbonyl)piperidin-4-yl]acetic acid
CID 79614951
[4-(2-cyclopropylpropylsulfonyl)piperazin-1-yl]-pyridin-2-ylmethanone
CID 146149234
(3-aminopyrrolidin-1-yl)-pyridin-2-ylmethanone
CID 59657975
[(3R)-3-aminopyrrolidin-1-yl]-pyridin-2-ylmethanone
CID 53256401

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-propan-2-yl-1-(pyridine-2-carbonyl)piperidine-4-carboxamide?
The IUPAC name of N-methyl-N-propan-2-yl-1-(pyridine-2-carbonyl)piperidine-4-carboxamide (CID 86983172) is N-methyl-N-propan-2-yl-1-(pyridine-2-carbonyl)piperidine-4-carboxamide.
What is the SMILES notation for N-methyl-N-propan-2-yl-1-(pyridine-2-carbonyl)piperidine-4-carboxamide?
The canonical SMILES for N-methyl-N-propan-2-yl-1-(pyridine-2-carbonyl)piperidine-4-carboxamide is CC(C)N(C)C(=O)C1CCN(C(=O)c2ccccn2)CC1.
What is the InChIKey of N-methyl-N-propan-2-yl-1-(pyridine-2-carbonyl)piperidine-4-carboxamide?
The InChIKey is YNDXVBCHWWVNNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O2/c1-12(2)18(3)15(20)13-7-10-19(11-8-13)16(21)14-6-4-5-9-17-14/h4-6,9,12-13H,7-8,10-11H2,1-3H3.
What are the key properties of N-methyl-N-propan-2-yl-1-(pyridine-2-carbonyl)piperidine-4-carboxamide?
N-methyl-N-propan-2-yl-1-(pyridine-2-carbonyl)piperidine-4-carboxamide has a molecular weight of 289.38 g/mol, XLogP of 1.80, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-propan-2-yl-1-(pyridine-2-carbonyl)piperidine-4-carboxamide is sourced from PubChem (CID 86983172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).