N-(3-methylbutyl)-2-(2-oxo-4-piperidin-1-yl-1-pyridinyl)acetamide

C17H27N3O2 — CID 90670068

IUPACN-(3-methylbutyl)-2-(2-oxo-4-piperidin-1-yl-1-pyridinyl)acetamide
SMILESCC(C)CCNC(=O)Cn1ccc(N2CCCCC2)cc1=O
InChIInChI=1S/C17H27N3O2/c1-14(2)6-8-18-16(21)13-20-11-7-15(12-17(20)22)19-9-4-3-5-10-19/h7,11-12,14H,3-6,8-10,13H2,1-2H3,(H,18,21)
InChIKeyAGSHMXHKUOPBJR-UHFFFAOYSA-N
MW305.42 g/mol
LogP2.00
Rot. Bonds6

About N-(3-methylbutyl)-2-(2-oxo-4-piperidin-1-yl-1-pyridinyl)acetamide

N-(3-methylbutyl)-2-(2-oxo-4-piperidin-1-yl-1-pyridinyl)acetamide (PubChem CID 90670068) has the molecular formula C17H27N3O2 and a molecular weight of 305.42 g/mol. Its IUPAC name is N-(3-methylbutyl)-2-(2-oxo-4-piperidin-1-yl-1-pyridinyl)acetamide.

Molecular Properties

Compound NameN-(3-methylbutyl)-2-(2-oxo-4-piperidin-1-yl-1-pyridinyl)acetamide
PubChem CID90670068
Molecular FormulaC17H27N3O2
Molecular Weight305.42 g/mol
Exact Mass305.21
IUPAC NameN-(3-methylbutyl)-2-(2-oxo-4-piperidin-1-yl-1-pyridinyl)acetamide
SMILESCC(C)CCNC(=O)Cn1ccc(N2CCCCC2)cc1=O
InChIInChI=1S/C17H27N3O2/c1-14(2)6-8-18-16(21)13-20-11-7-15(12-17(20)22)19-9-4-3-5-10-19/h7,11-12,14H,3-6,8-10,13H2,1-2H3,(H,18,21)
InChIKeyAGSHMXHKUOPBJR-UHFFFAOYSA-N
XLogP2.00
TPSA54.34 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.42
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[(1R)-1-[[2-[4-(diethylamino)-2-oxo-1-pyridinyl]acetyl]amino]-3-methylbutyl]boronic acid
CID 71697269
[(1R)-3-methyl-1-[[2-(2-oxo-4-piperidin-1-yl-1-pyridinyl)acetyl]amino]butyl]boronic acid
CID 71697360
[(1R)-3-methyl-1-[[2-[2-oxo-4-(4-prop-2-enylpiperazin-1-yl)-1-pyridinyl]acetyl]amino]butyl]boronic acid
CID 71697363
N-(3-methylbutyl)-2-(4-morpholin-4-yl-2-oxo-1-pyridinyl)acetamide
CID 90655131
2-(3-acetamido-2-oxo-1-pyridinyl)-N-cyclohexylacetamide
CID 45268244
[(1R)-3-methyl-1-[[2-[4-(4-methylpiperazin-1-yl)-2-oxo-1-pyridinyl]acetyl]amino]butyl]boronic acid
CID 71697362
2-[4-(diethylamino)-2-oxo-1-pyridinyl]-N-(3-methylbutyl)acetamide
CID 90670067
N-[1-[(1-methyl-2-oxo-4-pyridinyl)methyl]piperidin-3-yl]acetamide
CID 118741506
1-Methyl-3-(piperidin-4-ylmethylamino)pyridin-2-one
CID 171346454
N-(1-ethyl-6-oxo-3-pyridinyl)-2-(4-methylpiperidin-1-yl)acetamide
CID 71849994
(3S)-1-methyl-4-(6-oxo-1H-pyridine-2-carbonyl)-3-propan-2-ylpiperazin-2-one
CID 164630136
6-[(3S)-4-cyclopentyl-3-methylpiperazine-1-carbonyl]-1H-pyridin-2-one
CID 164640688

Frequently Asked Questions

What is the IUPAC name of N-(3-methylbutyl)-2-(2-oxo-4-piperidin-1-yl-1-pyridinyl)acetamide?
The IUPAC name of N-(3-methylbutyl)-2-(2-oxo-4-piperidin-1-yl-1-pyridinyl)acetamide (CID 90670068) is N-(3-methylbutyl)-2-(2-oxo-4-piperidin-1-yl-1-pyridinyl)acetamide.
What is the SMILES notation for N-(3-methylbutyl)-2-(2-oxo-4-piperidin-1-yl-1-pyridinyl)acetamide?
The canonical SMILES for N-(3-methylbutyl)-2-(2-oxo-4-piperidin-1-yl-1-pyridinyl)acetamide is CC(C)CCNC(=O)Cn1ccc(N2CCCCC2)cc1=O.
What is the InChIKey of N-(3-methylbutyl)-2-(2-oxo-4-piperidin-1-yl-1-pyridinyl)acetamide?
The InChIKey is AGSHMXHKUOPBJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3O2/c1-14(2)6-8-18-16(21)13-20-11-7-15(12-17(20)22)19-9-4-3-5-10-19/h7,11-12,14H,3-6,8-10,13H2,1-2H3,(H,18,21).
What are the key properties of N-(3-methylbutyl)-2-(2-oxo-4-piperidin-1-yl-1-pyridinyl)acetamide?
N-(3-methylbutyl)-2-(2-oxo-4-piperidin-1-yl-1-pyridinyl)acetamide has a molecular weight of 305.42 g/mol, XLogP of 2.00, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylbutyl)-2-(2-oxo-4-piperidin-1-yl-1-pyridinyl)acetamide is sourced from PubChem (CID 90670068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).