N-ethyl-1-(3-methoxypyridine-4-carbonyl)piperazine-2-carboxamide

C14H20N4O3 — CID 105064126

IUPACN-ethyl-1-(3-methoxypyridine-4-carbonyl)piperazine-2-carboxamide
SMILESCCNC(=O)C1CNCCN1C(=O)c1ccncc1OC
InChIInChI=1S/C14H20N4O3/c1-3-17-13(19)11-8-16-6-7-18(11)14(20)10-4-5-15-9-12(10)21-2/h4-5,9,11,16H,3,6-8H2,1-2H3,(H,17,19)
InChIKeyRAKXBFNDHJTXTN-UHFFFAOYSA-N
MW292.34 g/mol
LogP-0.36
Rot. Bonds4

About N-ethyl-1-(3-methoxypyridine-4-carbonyl)piperazine-2-carboxamide

N-ethyl-1-(3-methoxypyridine-4-carbonyl)piperazine-2-carboxamide (PubChem CID 105064126) has the molecular formula C14H20N4O3 and a molecular weight of 292.34 g/mol. Its IUPAC name is N-ethyl-1-(3-methoxypyridine-4-carbonyl)piperazine-2-carboxamide.

Molecular Properties

Compound NameN-ethyl-1-(3-methoxypyridine-4-carbonyl)piperazine-2-carboxamide
PubChem CID105064126
Molecular FormulaC14H20N4O3
Molecular Weight292.34 g/mol
Exact Mass292.15
IUPAC NameN-ethyl-1-(3-methoxypyridine-4-carbonyl)piperazine-2-carboxamide
SMILESCCNC(=O)C1CNCCN1C(=O)c1ccncc1OC
InChIInChI=1S/C14H20N4O3/c1-3-17-13(19)11-8-16-6-7-18(11)14(20)10-4-5-15-9-12(10)21-2/h4-5,9,11,16H,3,6-8H2,1-2H3,(H,17,19)
InChIKeyRAKXBFNDHJTXTN-UHFFFAOYSA-N
XLogP-0.36
TPSA83.56 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 5-0.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(4-ethyl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrol-5-yl)-(3-methoxy-4-pyridinyl)methanone
CID 105064142
2-[1-(3-methoxypyridine-4-carbonyl)-3-oxopiperazin-2-yl]acetic acid
CID 105063202
(2R)-1-(2-ethoxybenzoyl)-N-(pyridin-2-ylmethyl)piperazine-2-carboxamide
CID 95717707
[4-(ethylamino)piperidin-1-yl]-(3-methoxy-4-pyridinyl)methanone
CID 105062869
N-ethyl-1-(4-methyl-1,2-oxazole-5-carbonyl)piperazine-2-carboxamide
CID 66334816
1-(4,6-dimethoxypyrimidin-2-yl)-N-ethylpiperazine-2-carboxamide
CID 115355359
N-ethyl-1-(5-methoxypyrimidin-2-yl)piperazine-2-carboxamide
CID 114600957
N-ethyl-1-(5-iodothiophene-3-carbonyl)piperazine-2-carboxamide
CID 79694089
(2S)-1-(2-ethyl-4-methyl-1,3-oxazole-5-carbonyl)-N-(pyridin-4-ylmethyl)piperazine-2-carboxamide
CID 95708878
(3-methoxy-4-pyridinyl)-[2-(methylaminomethyl)piperidin-1-yl]methanone
CID 105064068
[2-(bromomethyl)-3-methylpyrrolidin-1-yl]-(3-methoxy-4-pyridinyl)methanone
CID 102787927
N-ethyl-3-methoxy-N-piperidin-3-ylpyridine-4-carboxamide
CID 105064085

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(3-methoxypyridine-4-carbonyl)piperazine-2-carboxamide?
The IUPAC name of N-ethyl-1-(3-methoxypyridine-4-carbonyl)piperazine-2-carboxamide (CID 105064126) is N-ethyl-1-(3-methoxypyridine-4-carbonyl)piperazine-2-carboxamide.
What is the SMILES notation for N-ethyl-1-(3-methoxypyridine-4-carbonyl)piperazine-2-carboxamide?
The canonical SMILES for N-ethyl-1-(3-methoxypyridine-4-carbonyl)piperazine-2-carboxamide is CCNC(=O)C1CNCCN1C(=O)c1ccncc1OC.
What is the InChIKey of N-ethyl-1-(3-methoxypyridine-4-carbonyl)piperazine-2-carboxamide?
The InChIKey is RAKXBFNDHJTXTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O3/c1-3-17-13(19)11-8-16-6-7-18(11)14(20)10-4-5-15-9-12(10)21-2/h4-5,9,11,16H,3,6-8H2,1-2H3,(H,17,19).
What are the key properties of N-ethyl-1-(3-methoxypyridine-4-carbonyl)piperazine-2-carboxamide?
N-ethyl-1-(3-methoxypyridine-4-carbonyl)piperazine-2-carboxamide has a molecular weight of 292.34 g/mol, XLogP of -0.36, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(3-methoxypyridine-4-carbonyl)piperazine-2-carboxamide is sourced from PubChem (CID 105064126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).