3-(methoxymethyl)-N-[2-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazol-3-yl]-1,2-oxazole-4-carboxamide

C19H20N4O3 — CID 164635258

IUPAC3-(methoxymethyl)-N-[2-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazol-3-yl]-1,2-oxazole-4-carboxamide
SMILESCOCc1nocc1C(=O)Nc1ccnn1[C@H]1CCCc2ccccc21
InChIInChI=1S/C19H20N4O3/c1-25-12-16-15(11-26-22-16)19(24)21-18-9-10-20-23(18)17-8-4-6-13-5-2-3-7-14(13)17/h2-3,5,7,9-11,17H,4,6,8,12H2,1H3,(H,21,24)/t17-/m0/s1
InChIKeySWMKDGYIUPLCQS-KRWDZBQOSA-N
MW352.39 g/mol
LogP3.20
Rot. Bonds5

About 3-(methoxymethyl)-N-[2-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazol-3-yl]-1,2-oxazole-4-carboxamide

3-(methoxymethyl)-N-[2-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazol-3-yl]-1,2-oxazole-4-carboxamide (PubChem CID 164635258) has the molecular formula C19H20N4O3 and a molecular weight of 352.39 g/mol. Its IUPAC name is 3-(methoxymethyl)-N-[2-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazol-3-yl]-1,2-oxazole-4-carboxamide.

Molecular Properties

Compound Name3-(methoxymethyl)-N-[2-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazol-3-yl]-1,2-oxazole-4-carboxamide
PubChem CID164635258
Molecular FormulaC19H20N4O3
Molecular Weight352.39 g/mol
Exact Mass352.15
IUPAC Name3-(methoxymethyl)-N-[2-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazol-3-yl]-1,2-oxazole-4-carboxamide
SMILESCOCc1nocc1C(=O)Nc1ccnn1[C@H]1CCCc2ccccc21
InChIInChI=1S/C19H20N4O3/c1-25-12-16-15(11-26-22-16)19(24)21-18-9-10-20-23(18)17-8-4-6-13-5-2-3-7-14(13)17/h2-3,5,7,9-11,17H,4,6,8,12H2,1H3,(H,21,24)/t17-/m0/s1
InChIKeySWMKDGYIUPLCQS-KRWDZBQOSA-N
XLogP3.20
TPSA82.18 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.39
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-methyl-N-[2-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazol-3-yl]-2H-triazole-4-carboxamide
CID 167921599
N-[2-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazol-3-yl]-2-thiophen-2-ylacetamide
CID 95240052
2-pyrrolidin-2-yl-N-[2-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazol-3-yl]acetamide
CID 119865826
3-(2-aminophenyl)-N-[2-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazol-3-yl]propanamide
CID 120612737
2-(5-chloro-2-pyridinyl)-N-[2-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazol-3-yl]acetamide
CID 164636807
2-(2',5'-dioxospiro[1,2-dihydroindene-3,4'-imidazolidine]-1'-yl)-N-[2-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazol-3-yl]acetamide
CID 154834618
3-methyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]-1,2-oxazole-4-carboxamide
CID 11149532
3-methyl-N-[4-methyl-1-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazol-5-yl]-1,2-oxazole-5-carboxamide
CID 95150327
5-amino-2-methyl-N-[4-methyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazol-5-yl]benzamide;hydrochloride
CID 120626408
2-methoxy-N-[2-(1-methylpiperidin-4-yl)pyrazol-3-yl]benzamide
CID 24817787
2-(6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-yl)pyrazol-3-amine
CID 16788368
N-(2-cyclopentylpyrazol-3-yl)-2-[[(1S)-2,3-dihydro-1H-inden-1-yl]-methylamino]acetamide
CID 95042358

Frequently Asked Questions

What is the IUPAC name of 3-(methoxymethyl)-N-[2-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazol-3-yl]-1,2-oxazole-4-carboxamide?
The IUPAC name of 3-(methoxymethyl)-N-[2-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazol-3-yl]-1,2-oxazole-4-carboxamide (CID 164635258) is 3-(methoxymethyl)-N-[2-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazol-3-yl]-1,2-oxazole-4-carboxamide.
What is the SMILES notation for 3-(methoxymethyl)-N-[2-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazol-3-yl]-1,2-oxazole-4-carboxamide?
The canonical SMILES for 3-(methoxymethyl)-N-[2-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazol-3-yl]-1,2-oxazole-4-carboxamide is COCc1nocc1C(=O)Nc1ccnn1[C@H]1CCCc2ccccc21.
What is the InChIKey of 3-(methoxymethyl)-N-[2-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazol-3-yl]-1,2-oxazole-4-carboxamide?
The InChIKey is SWMKDGYIUPLCQS-KRWDZBQOSA-N. The full InChI is InChI=1S/C19H20N4O3/c1-25-12-16-15(11-26-22-16)19(24)21-18-9-10-20-23(18)17-8-4-6-13-5-2-3-7-14(13)17/h2-3,5,7,9-11,17H,4,6,8,12H2,1H3,(H,21,24)/t17-/m0/s1.
What are the key properties of 3-(methoxymethyl)-N-[2-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazol-3-yl]-1,2-oxazole-4-carboxamide?
3-(methoxymethyl)-N-[2-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazol-3-yl]-1,2-oxazole-4-carboxamide has a molecular weight of 352.39 g/mol, XLogP of 3.20, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methoxymethyl)-N-[2-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazol-3-yl]-1,2-oxazole-4-carboxamide is sourced from PubChem (CID 164635258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).