N,N-diethyl-3-[1-(5-methylpyridine-2-carbonyl)piperidin-4-yl]propanamide

C19H29N3O2 — CID 166208087

IUPACN,N-diethyl-3-[1-(5-methylpyridine-2-carbonyl)piperidin-4-yl]propanamide
SMILESCCN(CC)C(=O)CCC1CCN(C(=O)c2ccc(C)cn2)CC1
InChIInChI=1S/C19H29N3O2/c1-4-21(5-2)18(23)9-7-16-10-12-22(13-11-16)19(24)17-8-6-15(3)14-20-17/h6,8,14,16H,4-5,7,9-13H2,1-3H3
InChIKeyVAYBKAYCEYSBKT-UHFFFAOYSA-N
MW331.46 g/mol
LogP2.89
Rot. Bonds6

About N,N-diethyl-3-[1-(5-methylpyridine-2-carbonyl)piperidin-4-yl]propanamide

N,N-diethyl-3-[1-(5-methylpyridine-2-carbonyl)piperidin-4-yl]propanamide (PubChem CID 166208087) has the molecular formula C19H29N3O2 and a molecular weight of 331.46 g/mol. Its IUPAC name is N,N-diethyl-3-[1-(5-methylpyridine-2-carbonyl)piperidin-4-yl]propanamide.

Molecular Properties

Compound NameN,N-diethyl-3-[1-(5-methylpyridine-2-carbonyl)piperidin-4-yl]propanamide
PubChem CID166208087
Molecular FormulaC19H29N3O2
Molecular Weight331.46 g/mol
Exact Mass331.23
IUPAC NameN,N-diethyl-3-[1-(5-methylpyridine-2-carbonyl)piperidin-4-yl]propanamide
SMILESCCN(CC)C(=O)CCC1CCN(C(=O)c2ccc(C)cn2)CC1
InChIInChI=1S/C19H29N3O2/c1-4-21(5-2)18(23)9-7-16-10-12-22(13-11-16)19(24)17-8-6-15(3)14-20-17/h6,8,14,16H,4-5,7,9-13H2,1-3H3
InChIKeyVAYBKAYCEYSBKT-UHFFFAOYSA-N
XLogP2.89
TPSA53.51 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.46
LogP ≤ 52.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

aziridin-1-yl-(5-methyl-2-pyridinyl)methanone
CID 126996011
N,N-diethyl-3-[1-(5-methyl-1,3-thiazol-2-yl)piperidin-4-yl]propanamide
CID 99843600
ethane;formic acid;(5-methyl-2-pyridinyl)-pyrrolidin-1-ylmethanone
CID 142369498
(5-chloropyrazin-2-yl)-[4-(diethylaminomethyl)piperidin-1-yl]methanone
CID 107257834
(4-methyl-1,4-diazepan-1-yl)-(5-methyl-2-pyridinyl)methanone
CID 97240980
[4-(chloromethyl)piperidin-1-yl]-(5-fluoro-2-pyridinyl)methanone
CID 104643097
(5-chloropyrazin-2-yl)-[4-[(dimethylamino)methyl]piperidin-1-yl]methanone
CID 107257835
5-methyl-3-[[1-(5-methylpyrazine-2-carbonyl)piperidin-4-yl]methyl]pyrimidin-4-one
CID 126940641
(5-bromo-2-pyridinyl)-[4-(ethylaminomethyl)piperidin-1-yl]methanone;dihydrochloride
CID 119646070
6-[4-[2-(4-methylphenyl)ethyl]piperidine-1-carbonyl]-2-propylpyridazin-3-one
CID 55466009
[3-(methoxymethyl)-2-methyl-2,8-diazaspiro[4.5]decan-8-yl]-(5-methyl-2-pyridinyl)methanone
CID 131663252
(5-chloropyrazin-2-yl)-[4-(diethylamino)piperidin-1-yl]methanone
CID 107257837

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-3-[1-(5-methylpyridine-2-carbonyl)piperidin-4-yl]propanamide?
The IUPAC name of N,N-diethyl-3-[1-(5-methylpyridine-2-carbonyl)piperidin-4-yl]propanamide (CID 166208087) is N,N-diethyl-3-[1-(5-methylpyridine-2-carbonyl)piperidin-4-yl]propanamide.
What is the SMILES notation for N,N-diethyl-3-[1-(5-methylpyridine-2-carbonyl)piperidin-4-yl]propanamide?
The canonical SMILES for N,N-diethyl-3-[1-(5-methylpyridine-2-carbonyl)piperidin-4-yl]propanamide is CCN(CC)C(=O)CCC1CCN(C(=O)c2ccc(C)cn2)CC1.
What is the InChIKey of N,N-diethyl-3-[1-(5-methylpyridine-2-carbonyl)piperidin-4-yl]propanamide?
The InChIKey is VAYBKAYCEYSBKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N3O2/c1-4-21(5-2)18(23)9-7-16-10-12-22(13-11-16)19(24)17-8-6-15(3)14-20-17/h6,8,14,16H,4-5,7,9-13H2,1-3H3.
What are the key properties of N,N-diethyl-3-[1-(5-methylpyridine-2-carbonyl)piperidin-4-yl]propanamide?
N,N-diethyl-3-[1-(5-methylpyridine-2-carbonyl)piperidin-4-yl]propanamide has a molecular weight of 331.46 g/mol, XLogP of 2.89, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-3-[1-(5-methylpyridine-2-carbonyl)piperidin-4-yl]propanamide is sourced from PubChem (CID 166208087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).