1-[2-(3-acetamidopiperidin-1-yl)acetyl]-N-methyl-N-propan-2-ylpiperidine-4-carboxamide

C19H34N4O3 — CID 87014549

IUPAC1-[2-(3-acetamidopiperidin-1-yl)acetyl]-N-methyl-N-propan-2-ylpiperidine-4-carboxamide
SMILESCC(=O)NC1CCCN(CC(=O)N2CCC(C(=O)N(C)C(C)C)CC2)C1
InChIInChI=1S/C19H34N4O3/c1-14(2)21(4)19(26)16-7-10-23(11-8-16)18(25)13-22-9-5-6-17(12-22)20-15(3)24/h14,16-17H,5-13H2,1-4H3,(H,20,24)
InChIKeyZZKKZVREAFNROH-UHFFFAOYSA-N
MW366.51 g/mol
LogP0.69
Rot. Bonds5

About 1-[2-(3-acetamidopiperidin-1-yl)acetyl]-N-methyl-N-propan-2-ylpiperidine-4-carboxamide

1-[2-(3-acetamidopiperidin-1-yl)acetyl]-N-methyl-N-propan-2-ylpiperidine-4-carboxamide (PubChem CID 87014549) has the molecular formula C19H34N4O3 and a molecular weight of 366.51 g/mol. Its IUPAC name is 1-[2-(3-acetamidopiperidin-1-yl)acetyl]-N-methyl-N-propan-2-ylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-[2-(3-acetamidopiperidin-1-yl)acetyl]-N-methyl-N-propan-2-ylpiperidine-4-carboxamide
PubChem CID87014549
Molecular FormulaC19H34N4O3
Molecular Weight366.51 g/mol
Exact Mass366.26
IUPAC Name1-[2-(3-acetamidopiperidin-1-yl)acetyl]-N-methyl-N-propan-2-ylpiperidine-4-carboxamide
SMILESCC(=O)NC1CCCN(CC(=O)N2CCC(C(=O)N(C)C(C)C)CC2)C1
InChIInChI=1S/C19H34N4O3/c1-14(2)21(4)19(26)16-7-10-23(11-8-16)18(25)13-22-9-5-6-17(12-22)20-15(3)24/h14,16-17H,5-13H2,1-4H3,(H,20,24)
InChIKeyZZKKZVREAFNROH-UHFFFAOYSA-N
XLogP0.69
TPSA72.96 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.51
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(3S)-1-(2-morpholin-4-yl-2-oxoethyl)piperidin-3-yl]acetamide
CID 97312328
1-[2-(3,5-dimethylpiperidin-1-yl)acetyl]-N-methyl-N-propan-2-ylpiperidine-4-carboxamide
CID 87012543
2-(3-acetamidopiperidin-1-yl)-N-cyclopropyl-N-(2-methylpropyl)acetamide
CID 87017795
1-(azepan-1-yl)-2-[3-(methylamino)piperidin-1-yl]ethanone;hydrochloride
CID 119918785
1-(2-cyclopentylsulfinylacetyl)-N-methyl-N-propan-2-ylpiperidine-4-carboxamide
CID 75381738
1-[4-(cyclopropanecarbonyl)piperazin-1-yl]-2-[3-(methylamino)piperidin-1-yl]ethanone
CID 119919525
N-[1-[2-(4-aminopiperidin-1-yl)acetyl]piperidin-3-yl]acetamide;hydrochloride
CID 119908203
2-[3-(methylamino)piperidin-1-yl]-1-(4-methylpiperazin-1-yl)ethanone
CID 62545473
1-(4-cyclohexylbutanoyl)-N-methyl-N-propan-2-ylpiperidine-4-carboxamide
CID 86983173
N-[1-(2-morpholin-4-yl-2-oxoethyl)piperidin-3-yl]cyclobutanecarboxamide
CID 171334346
1-[2-[(2,2-dimethylcyclopentyl)amino]acetyl]-N-methyl-N-propan-2-ylpiperidine-4-carboxamide
CID 131963897
2-(3-acetylpiperidin-1-yl)-1-pyrrolidin-1-ylethanone
CID 63844591

Frequently Asked Questions

What is the IUPAC name of 1-[2-(3-acetamidopiperidin-1-yl)acetyl]-N-methyl-N-propan-2-ylpiperidine-4-carboxamide?
The IUPAC name of 1-[2-(3-acetamidopiperidin-1-yl)acetyl]-N-methyl-N-propan-2-ylpiperidine-4-carboxamide (CID 87014549) is 1-[2-(3-acetamidopiperidin-1-yl)acetyl]-N-methyl-N-propan-2-ylpiperidine-4-carboxamide.
What is the SMILES notation for 1-[2-(3-acetamidopiperidin-1-yl)acetyl]-N-methyl-N-propan-2-ylpiperidine-4-carboxamide?
The canonical SMILES for 1-[2-(3-acetamidopiperidin-1-yl)acetyl]-N-methyl-N-propan-2-ylpiperidine-4-carboxamide is CC(=O)NC1CCCN(CC(=O)N2CCC(C(=O)N(C)C(C)C)CC2)C1.
What is the InChIKey of 1-[2-(3-acetamidopiperidin-1-yl)acetyl]-N-methyl-N-propan-2-ylpiperidine-4-carboxamide?
The InChIKey is ZZKKZVREAFNROH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H34N4O3/c1-14(2)21(4)19(26)16-7-10-23(11-8-16)18(25)13-22-9-5-6-17(12-22)20-15(3)24/h14,16-17H,5-13H2,1-4H3,(H,20,24).
What are the key properties of 1-[2-(3-acetamidopiperidin-1-yl)acetyl]-N-methyl-N-propan-2-ylpiperidine-4-carboxamide?
1-[2-(3-acetamidopiperidin-1-yl)acetyl]-N-methyl-N-propan-2-ylpiperidine-4-carboxamide has a molecular weight of 366.51 g/mol, XLogP of 0.69, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(3-acetamidopiperidin-1-yl)acetyl]-N-methyl-N-propan-2-ylpiperidine-4-carboxamide is sourced from PubChem (CID 87014549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).