N-ethyl-1-[2-(3-methyl-2-pyridinyl)acetyl]piperazine-2-carboxamide

C15H22N4O2 — CID 107148474

IUPACN-ethyl-1-[2-(3-methyl-2-pyridinyl)acetyl]piperazine-2-carboxamide
SMILESCCNC(=O)C1CNCCN1C(=O)Cc1ncccc1C
InChIInChI=1S/C15H22N4O2/c1-3-17-15(21)13-10-16-7-8-19(13)14(20)9-12-11(2)5-4-6-18-12/h4-6,13,16H,3,7-10H2,1-2H3,(H,17,21)
InChIKeyYAZZEKKVDHOKTP-UHFFFAOYSA-N
MW290.37 g/mol
LogP-0.13
Rot. Bonds4

About N-ethyl-1-[2-(3-methyl-2-pyridinyl)acetyl]piperazine-2-carboxamide

N-ethyl-1-[2-(3-methyl-2-pyridinyl)acetyl]piperazine-2-carboxamide (PubChem CID 107148474) has the molecular formula C15H22N4O2 and a molecular weight of 290.37 g/mol. Its IUPAC name is N-ethyl-1-[2-(3-methyl-2-pyridinyl)acetyl]piperazine-2-carboxamide.

Molecular Properties

Compound NameN-ethyl-1-[2-(3-methyl-2-pyridinyl)acetyl]piperazine-2-carboxamide
PubChem CID107148474
Molecular FormulaC15H22N4O2
Molecular Weight290.37 g/mol
Exact Mass290.17
IUPAC NameN-ethyl-1-[2-(3-methyl-2-pyridinyl)acetyl]piperazine-2-carboxamide
SMILESCCNC(=O)C1CNCCN1C(=O)Cc1ncccc1C
InChIInChI=1S/C15H22N4O2/c1-3-17-15(21)13-10-16-7-8-19(13)14(20)9-12-11(2)5-4-6-18-12/h4-6,13,16H,3,7-10H2,1-2H3,(H,17,21)
InChIKeyYAZZEKKVDHOKTP-UHFFFAOYSA-N
XLogP-0.13
TPSA74.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 5-0.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-methyl-2-pyridinyl)-1-piperazin-1-ylethanone
CID 107147060
2-(3-methyl-2-pyridinyl)-N-[(3S)-piperidin-3-yl]acetamide
CID 107148570
(2S)-1-[2-(3-methyl-2-pyridinyl)acetyl]pyrrolidine-2-carboxylic acid
CID 107147142
1-(2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrol-5-yl)-2-(3-methyl-2-pyridinyl)ethanone
CID 107148490
1-(1,4-diazepan-1-yl)-2-(3-methyl-2-pyridinyl)ethanone
CID 107147061
1-[2-(3-methyl-2-pyridinyl)acetyl]azepane-2-carboxylic acid
CID 107147224
N-ethyl-1-(4-methyl-1,2-oxazole-5-carbonyl)piperazine-2-carboxamide
CID 66334816
N-ethyl-1-(2-propan-2-yloxyacetyl)piperazine-2-carboxamide
CID 112603458
(2R)-N-(pyridin-2-ylmethyl)-1-[2-(3,4,5-trimethylpyrazol-1-yl)acetyl]piperazine-2-carboxamide
CID 95717599
N-[(3-methyl-2-pyridinyl)methyl]pyrrolidine-3-carboxamide;dihydrochloride
CID 119869411
N-cyclopropyl-1-[2-(2-methylphenyl)sulfanylacetyl]piperazine-2-carboxamide
CID 56902915
(2S)-1-[2-(4-fluorophenyl)acetyl]-N-methylpiperazine-2-carboxamide
CID 124513931

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-[2-(3-methyl-2-pyridinyl)acetyl]piperazine-2-carboxamide?
The IUPAC name of N-ethyl-1-[2-(3-methyl-2-pyridinyl)acetyl]piperazine-2-carboxamide (CID 107148474) is N-ethyl-1-[2-(3-methyl-2-pyridinyl)acetyl]piperazine-2-carboxamide.
What is the SMILES notation for N-ethyl-1-[2-(3-methyl-2-pyridinyl)acetyl]piperazine-2-carboxamide?
The canonical SMILES for N-ethyl-1-[2-(3-methyl-2-pyridinyl)acetyl]piperazine-2-carboxamide is CCNC(=O)C1CNCCN1C(=O)Cc1ncccc1C.
What is the InChIKey of N-ethyl-1-[2-(3-methyl-2-pyridinyl)acetyl]piperazine-2-carboxamide?
The InChIKey is YAZZEKKVDHOKTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O2/c1-3-17-15(21)13-10-16-7-8-19(13)14(20)9-12-11(2)5-4-6-18-12/h4-6,13,16H,3,7-10H2,1-2H3,(H,17,21).
What are the key properties of N-ethyl-1-[2-(3-methyl-2-pyridinyl)acetyl]piperazine-2-carboxamide?
N-ethyl-1-[2-(3-methyl-2-pyridinyl)acetyl]piperazine-2-carboxamide has a molecular weight of 290.37 g/mol, XLogP of -0.13, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-[2-(3-methyl-2-pyridinyl)acetyl]piperazine-2-carboxamide is sourced from PubChem (CID 107148474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).