(3R)-N-[2-(4-acetylpiperazin-1-yl)-6-methoxy-3-pyridinyl]oxolane-3-carboxamide

C17H24N4O4 — CID 95299587

IUPAC(3R)-N-[2-(4-acetylpiperazin-1-yl)-6-methoxy-3-pyridinyl]oxolane-3-carboxamide
SMILESCOc1ccc(NC(=O)[C@@H]2CCOC2)c(N2CCN(C(C)=O)CC2)n1
InChIInChI=1S/C17H24N4O4/c1-12(22)20-6-8-21(9-7-20)16-14(3-4-15(19-16)24-2)18-17(23)13-5-10-25-11-13/h3-4,13H,5-11H2,1-2H3,(H,18,23)/t13-/m1/s1
InChIKeyOLNHPAKOXMWSQF-CYBMUJFWSA-N
MW348.40 g/mol
LogP0.73
Rot. Bonds4

About (3R)-N-[2-(4-acetylpiperazin-1-yl)-6-methoxy-3-pyridinyl]oxolane-3-carboxamide

(3R)-N-[2-(4-acetylpiperazin-1-yl)-6-methoxy-3-pyridinyl]oxolane-3-carboxamide (PubChem CID 95299587) has the molecular formula C17H24N4O4 and a molecular weight of 348.40 g/mol. Its IUPAC name is (3R)-N-[2-(4-acetylpiperazin-1-yl)-6-methoxy-3-pyridinyl]oxolane-3-carboxamide.

Molecular Properties

Compound Name(3R)-N-[2-(4-acetylpiperazin-1-yl)-6-methoxy-3-pyridinyl]oxolane-3-carboxamide
PubChem CID95299587
Molecular FormulaC17H24N4O4
Molecular Weight348.40 g/mol
Exact Mass348.18
IUPAC Name(3R)-N-[2-(4-acetylpiperazin-1-yl)-6-methoxy-3-pyridinyl]oxolane-3-carboxamide
SMILESCOc1ccc(NC(=O)[C@@H]2CCOC2)c(N2CCN(C(C)=O)CC2)n1
InChIInChI=1S/C17H24N4O4/c1-12(22)20-6-8-21(9-7-20)16-14(3-4-15(19-16)24-2)18-17(23)13-5-10-25-11-13/h3-4,13H,5-11H2,1-2H3,(H,18,23)/t13-/m1/s1
InChIKeyOLNHPAKOXMWSQF-CYBMUJFWSA-N
XLogP0.73
TPSA84.00 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.40
LogP ≤ 50.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze (3R)-N-[2-(4-acetylpiperazin-1-yl)-6-methoxy-3-pyridinyl]oxolane-3-carboxamide with MolForge

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Related Compounds

(1R,6R)-6-[(6-methoxy-2-morpholin-4-yl-3-pyridinyl)carbamoyl]-3,4-dimethylcyclohex-3-ene-1-carboxylic acid
CID 7219186
N-[2-(4-acetylpiperazin-1-yl)-6-methoxy-3-pyridinyl]-2-methylpentanamide
CID 75420641
6-[(6-methoxy-2-morpholin-4-yl-3-pyridinyl)carbamoyl]-3,4-dimethylcyclohex-3-ene-1-carboxylic acid
CID 2826406
N-(6-methoxypyridazin-3-yl)oxolane-3-carboxamide
CID 155503304
N-[2-(4-acetylpiperazin-1-yl)-6-methoxy-3-pyridinyl]-2-(2-methylphenoxy)acetamide
CID 51132365
N-(5-bromo-2-methoxyphenyl)oxolane-3-carboxamide
CID 47494478
methyl 5-methyl-2-(oxolane-3-carbonylamino)benzoate
CID 61278907
1-acetyl-N-(4-methoxy-2,3-dimethylphenyl)piperidine-4-carboxamide
CID 110792941
[3-(6-methoxypyridazin-3-yl)oxypyrrolidin-1-yl]-(oxolan-3-yl)methanone
CID 91627512
N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]oxolane-3-carboxamide
CID 86850853
(3R)-N-[3-(4-methoxyphenyl)-1,2,4-thiadiazol-5-yl]oxolane-3-carboxamide
CID 95313237
1-acetyl-N-(2-methoxyphenyl)piperidine-4-carboxamide
CID 6468496

Frequently Asked Questions

What is the IUPAC name of (3R)-N-[2-(4-acetylpiperazin-1-yl)-6-methoxy-3-pyridinyl]oxolane-3-carboxamide?
The IUPAC name of (3R)-N-[2-(4-acetylpiperazin-1-yl)-6-methoxy-3-pyridinyl]oxolane-3-carboxamide (CID 95299587) is (3R)-N-[2-(4-acetylpiperazin-1-yl)-6-methoxy-3-pyridinyl]oxolane-3-carboxamide.
What is the SMILES notation for (3R)-N-[2-(4-acetylpiperazin-1-yl)-6-methoxy-3-pyridinyl]oxolane-3-carboxamide?
The canonical SMILES for (3R)-N-[2-(4-acetylpiperazin-1-yl)-6-methoxy-3-pyridinyl]oxolane-3-carboxamide is COc1ccc(NC(=O)[C@@H]2CCOC2)c(N2CCN(C(C)=O)CC2)n1.
What is the InChIKey of (3R)-N-[2-(4-acetylpiperazin-1-yl)-6-methoxy-3-pyridinyl]oxolane-3-carboxamide?
The InChIKey is OLNHPAKOXMWSQF-CYBMUJFWSA-N. The full InChI is InChI=1S/C17H24N4O4/c1-12(22)20-6-8-21(9-7-20)16-14(3-4-15(19-16)24-2)18-17(23)13-5-10-25-11-13/h3-4,13H,5-11H2,1-2H3,(H,18,23)/t13-/m1/s1.
What are the key properties of (3R)-N-[2-(4-acetylpiperazin-1-yl)-6-methoxy-3-pyridinyl]oxolane-3-carboxamide?
(3R)-N-[2-(4-acetylpiperazin-1-yl)-6-methoxy-3-pyridinyl]oxolane-3-carboxamide has a molecular weight of 348.40 g/mol, XLogP of 0.73, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-[2-(4-acetylpiperazin-1-yl)-6-methoxy-3-pyridinyl]oxolane-3-carboxamide is sourced from PubChem (CID 95299587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).