6-(3-methylpiperidin-1-yl)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide

C21H27N3O2 — CID 109161701

IUPAC6-(3-methylpiperidin-1-yl)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide
SMILESCC1CCCN(c2ccc(C(=O)Nc3ccc(OC(C)C)cc3)cn2)C1
InChIInChI=1S/C21H27N3O2/c1-15(2)26-19-9-7-18(8-10-19)23-21(25)17-6-11-20(22-13-17)24-12-4-5-16(3)14-24/h6-11,13,15-16H,4-5,12,14H2,1-3H3,(H,23,25)
InChIKeyNWTWJCFMUOEUQP-UHFFFAOYSA-N
MW353.47 g/mol
LogP4.36
Rot. Bonds5

About 6-(3-methylpiperidin-1-yl)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide

6-(3-methylpiperidin-1-yl)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide (PubChem CID 109161701) has the molecular formula C21H27N3O2 and a molecular weight of 353.47 g/mol. Its IUPAC name is 6-(3-methylpiperidin-1-yl)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-(3-methylpiperidin-1-yl)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide
PubChem CID109161701
Molecular FormulaC21H27N3O2
Molecular Weight353.47 g/mol
Exact Mass353.21
IUPAC Name6-(3-methylpiperidin-1-yl)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide
SMILESCC1CCCN(c2ccc(C(=O)Nc3ccc(OC(C)C)cc3)cn2)C1
InChIInChI=1S/C21H27N3O2/c1-15(2)26-19-9-7-18(8-10-19)23-21(25)17-6-11-20(22-13-17)24-12-4-5-16(3)14-24/h6-11,13,15-16H,4-5,12,14H2,1-3H3,(H,23,25)
InChIKeyNWTWJCFMUOEUQP-UHFFFAOYSA-N
XLogP4.36
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.47
LogP ≤ 54.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[6-(3-methylpiperidin-1-yl)-3-pyridinyl]-4-propan-2-yloxybenzenesulfonamide
CID 113015711
3,5-dimethoxy-N-[6-(3-methylpiperidin-1-yl)-3-pyridinyl]benzamide
CID 113015617
6-(2-ethylpiperidin-1-yl)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide
CID 109161624
N-(4-acetamidophenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
CID 109152569
N-[2-(4-methoxyphenyl)ethyl]-6-(3-methylpiperidin-1-yl)pyridine-3-carboxamide
CID 109159052
6-(3-methylpiperidin-1-yl)-N-[2-(trifluoromethyl)phenyl]pyridine-3-carboxamide
CID 109161705
N-(4-bromo-2-methylphenyl)-6-(3-methylpiperidin-1-yl)pyridine-3-carboxamide
CID 109161724
6-(2-methyl-2,3-dihydroindol-1-yl)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide
CID 109164303
N-[6-(3-methylpiperidin-1-yl)-3-pyridinyl]cyclobutanecarboxamide
CID 113015663
ethyl N-[6-(3-methylpiperidin-1-yl)-3-pyridinyl]carbamate
CID 113015658
6-(azepan-1-yl)-N-[4-[(1R,2S)-2-hydroxycyclohexyl]oxyphenyl]pyridine-3-carboxamide
CID 99809452
2-(3-methylpiperidin-1-yl)-N-(4-propan-2-yloxyphenyl)acetamide
CID 109006515

Frequently Asked Questions

What is the IUPAC name of 6-(3-methylpiperidin-1-yl)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide?
The IUPAC name of 6-(3-methylpiperidin-1-yl)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide (CID 109161701) is 6-(3-methylpiperidin-1-yl)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-(3-methylpiperidin-1-yl)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide?
The canonical SMILES for 6-(3-methylpiperidin-1-yl)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide is CC1CCCN(c2ccc(C(=O)Nc3ccc(OC(C)C)cc3)cn2)C1.
What is the InChIKey of 6-(3-methylpiperidin-1-yl)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide?
The InChIKey is NWTWJCFMUOEUQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H27N3O2/c1-15(2)26-19-9-7-18(8-10-19)23-21(25)17-6-11-20(22-13-17)24-12-4-5-16(3)14-24/h6-11,13,15-16H,4-5,12,14H2,1-3H3,(H,23,25).
What are the key properties of 6-(3-methylpiperidin-1-yl)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide?
6-(3-methylpiperidin-1-yl)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide has a molecular weight of 353.47 g/mol, XLogP of 4.36, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-methylpiperidin-1-yl)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 109161701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).