2-[1-[6-(diethylamino)pyridine-3-carbonyl]piperidin-4-yl]acetamide

C17H26N4O2 — CID 48677877

IUPAC2-[1-[6-(diethylamino)pyridine-3-carbonyl]piperidin-4-yl]acetamide
SMILESCCN(CC)c1ccc(C(=O)N2CCC(CC(N)=O)CC2)cn1
InChIInChI=1S/C17H26N4O2/c1-3-20(4-2)16-6-5-14(12-19-16)17(23)21-9-7-13(8-10-21)11-15(18)22/h5-6,12-13H,3-4,7-11H2,1-2H3,(H2,18,22)
InChIKeyIFRCRVQDGIRCPN-UHFFFAOYSA-N
MW318.42 g/mol
LogP1.66
Rot. Bonds6

About 2-[1-[6-(diethylamino)pyridine-3-carbonyl]piperidin-4-yl]acetamide

2-[1-[6-(diethylamino)pyridine-3-carbonyl]piperidin-4-yl]acetamide (PubChem CID 48677877) has the molecular formula C17H26N4O2 and a molecular weight of 318.42 g/mol. Its IUPAC name is 2-[1-[6-(diethylamino)pyridine-3-carbonyl]piperidin-4-yl]acetamide.

Molecular Properties

Compound Name2-[1-[6-(diethylamino)pyridine-3-carbonyl]piperidin-4-yl]acetamide
PubChem CID48677877
Molecular FormulaC17H26N4O2
Molecular Weight318.42 g/mol
Exact Mass318.21
IUPAC Name2-[1-[6-(diethylamino)pyridine-3-carbonyl]piperidin-4-yl]acetamide
SMILESCCN(CC)c1ccc(C(=O)N2CCC(CC(N)=O)CC2)cn1
InChIInChI=1S/C17H26N4O2/c1-3-20(4-2)16-6-5-14(12-19-16)17(23)21-9-7-13(8-10-21)11-15(18)22/h5-6,12-13H,3-4,7-11H2,1-2H3,(H2,18,22)
InChIKeyIFRCRVQDGIRCPN-UHFFFAOYSA-N
XLogP1.66
TPSA79.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.42
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[1-(6-chloropyridine-3-carbonyl)piperidin-4-yl]acetamide
CID 47290627
[6-(diethylamino)-3-pyridinyl]-[4-(N-methylanilino)piperidin-1-yl]methanone
CID 48679733
1-[1-[6-(diethylamino)pyridine-3-carbonyl]piperidin-4-yl]imidazolidin-2-one
CID 48661370
[1-[6-(diethylamino)pyridine-3-carbonyl]piperidin-4-yl]-(2,6-dimethylmorpholin-4-yl)methanone
CID 48658257
[6-[ethyl(propyl)amino]-3-pyridinyl]-[3-(methylaminomethyl)pyrrolidin-1-yl]methanone;dihydrochloride
CID 119540285
2-[1-(4-hydroxybenzoyl)piperidin-4-yl]acetamide
CID 54989392
2-[1-(6-methylpyridine-3-carbonyl)piperidin-4-yl]acetic acid
CID 79615240
1-[4-[6-[benzyl(ethyl)amino]pyridine-3-carbonyl]piperazin-1-yl]ethanone
CID 109155193
[6-[[(2S)-1-hydroxypropan-2-yl]-methylamino]-3-pyridinyl]-(4-methylpiperidin-1-yl)methanone
CID 126817379
[6-(diethylamino)-3-pyridinyl]-[(2S)-2-[(2S)-1-methylpyrrolidin-2-yl]pyrrolidin-1-yl]methanone
CID 95291325
[6-(diethylamino)-3-pyridinyl]-[4-(2-methoxybenzoyl)-1,4-diazepan-1-yl]methanone
CID 48680586
[6-(diethylamino)-3-pyridinyl]-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]methanone
CID 48652759

Frequently Asked Questions

What is the IUPAC name of 2-[1-[6-(diethylamino)pyridine-3-carbonyl]piperidin-4-yl]acetamide?
The IUPAC name of 2-[1-[6-(diethylamino)pyridine-3-carbonyl]piperidin-4-yl]acetamide (CID 48677877) is 2-[1-[6-(diethylamino)pyridine-3-carbonyl]piperidin-4-yl]acetamide.
What is the SMILES notation for 2-[1-[6-(diethylamino)pyridine-3-carbonyl]piperidin-4-yl]acetamide?
The canonical SMILES for 2-[1-[6-(diethylamino)pyridine-3-carbonyl]piperidin-4-yl]acetamide is CCN(CC)c1ccc(C(=O)N2CCC(CC(N)=O)CC2)cn1.
What is the InChIKey of 2-[1-[6-(diethylamino)pyridine-3-carbonyl]piperidin-4-yl]acetamide?
The InChIKey is IFRCRVQDGIRCPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N4O2/c1-3-20(4-2)16-6-5-14(12-19-16)17(23)21-9-7-13(8-10-21)11-15(18)22/h5-6,12-13H,3-4,7-11H2,1-2H3,(H2,18,22).
What are the key properties of 2-[1-[6-(diethylamino)pyridine-3-carbonyl]piperidin-4-yl]acetamide?
2-[1-[6-(diethylamino)pyridine-3-carbonyl]piperidin-4-yl]acetamide has a molecular weight of 318.42 g/mol, XLogP of 1.66, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[6-(diethylamino)pyridine-3-carbonyl]piperidin-4-yl]acetamide is sourced from PubChem (CID 48677877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).