1-methyl-3-[(3R)-oxolan-3-yl]-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazole-4-carboxamide

C19H23N3O2 — CID 129472548

IUPAC1-methyl-3-[(3R)-oxolan-3-yl]-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazole-4-carboxamide
SMILESCn1cc(C(=O)N[C@@H]2CCCc3ccccc32)c([C@H]2CCOC2)n1
InChIInChI=1S/C19H23N3O2/c1-22-11-16(18(21-22)14-9-10-24-12-14)19(23)20-17-8-4-6-13-5-2-3-7-15(13)17/h2-3,5,7,11,14,17H,4,6,8-10,12H2,1H3,(H,20,23)/t14-,17+/m0/s1
InChIKeySYKZQUJHTUFQMB-WMLDXEAASA-N
MW325.41 g/mol
LogP2.73
Rot. Bonds3

About 1-methyl-3-[(3R)-oxolan-3-yl]-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazole-4-carboxamide

1-methyl-3-[(3R)-oxolan-3-yl]-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazole-4-carboxamide (PubChem CID 129472548) has the molecular formula C19H23N3O2 and a molecular weight of 325.41 g/mol. Its IUPAC name is 1-methyl-3-[(3R)-oxolan-3-yl]-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazole-4-carboxamide.

Molecular Properties

Compound Name1-methyl-3-[(3R)-oxolan-3-yl]-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazole-4-carboxamide
PubChem CID129472548
Molecular FormulaC19H23N3O2
Molecular Weight325.41 g/mol
Exact Mass325.18
IUPAC Name1-methyl-3-[(3R)-oxolan-3-yl]-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazole-4-carboxamide
SMILESCn1cc(C(=O)N[C@@H]2CCCc3ccccc32)c([C@H]2CCOC2)n1
InChIInChI=1S/C19H23N3O2/c1-22-11-16(18(21-22)14-9-10-24-12-14)19(23)20-17-8-4-6-13-5-2-3-7-15(13)17/h2-3,5,7,11,14,17H,4,6,8-10,12H2,1H3,(H,20,23)/t14-,17+/m0/s1
InChIKeySYKZQUJHTUFQMB-WMLDXEAASA-N
XLogP2.73
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(3S)-2,3-dihydro-1-benzofuran-3-yl]-1-methyl-3-[(3S)-oxolan-3-yl]pyrazole-4-carboxamide
CID 129473435
N-[(3R)-2,3-dihydro-1-benzofuran-3-yl]-1-methyl-3-[(3S)-oxolan-3-yl]pyrazole-4-carboxamide
CID 129473437
3-methyl-1-propyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-4-carboxamide
CID 131898012
1-methyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazole-3-carboxamide
CID 35324690
1-methyl-3-(oxolan-3-yl)-N-(1-propylpiperidin-4-yl)pyrazole-4-carboxamide
CID 128995752
3-methyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]-1,2-oxazole-4-carboxamide
CID 11149532
N-cyclobutylsulfonyl-1-methyl-3-(oxolan-3-yl)pyrazole-4-carboxamide
CID 136538400
1,3,5-trimethyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-4-carboxamide
CID 45148404
N-(1,2,3,4-tetrahydronaphthalen-1-yl)-2-(tetrazol-1-yl)benzamide
CID 4879166
2,3,4,5,6-pentafluoro-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide
CID 71474180
3-cyclopentyl-N-[(1S,2R)-1-methoxy-2,3-dihydro-1H-inden-2-yl]-1-methylpyrazole-4-carboxamide
CID 136588660
6-cyclopropyl-1,3-dimethyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazolo[5,4-b]pyridine-4-carboxamide
CID 45148429

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-[(3R)-oxolan-3-yl]-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazole-4-carboxamide?
The IUPAC name of 1-methyl-3-[(3R)-oxolan-3-yl]-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazole-4-carboxamide (CID 129472548) is 1-methyl-3-[(3R)-oxolan-3-yl]-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazole-4-carboxamide.
What is the SMILES notation for 1-methyl-3-[(3R)-oxolan-3-yl]-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazole-4-carboxamide?
The canonical SMILES for 1-methyl-3-[(3R)-oxolan-3-yl]-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazole-4-carboxamide is Cn1cc(C(=O)N[C@@H]2CCCc3ccccc32)c([C@H]2CCOC2)n1.
What is the InChIKey of 1-methyl-3-[(3R)-oxolan-3-yl]-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazole-4-carboxamide?
The InChIKey is SYKZQUJHTUFQMB-WMLDXEAASA-N. The full InChI is InChI=1S/C19H23N3O2/c1-22-11-16(18(21-22)14-9-10-24-12-14)19(23)20-17-8-4-6-13-5-2-3-7-15(13)17/h2-3,5,7,11,14,17H,4,6,8-10,12H2,1H3,(H,20,23)/t14-,17+/m0/s1.
What are the key properties of 1-methyl-3-[(3R)-oxolan-3-yl]-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazole-4-carboxamide?
1-methyl-3-[(3R)-oxolan-3-yl]-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazole-4-carboxamide has a molecular weight of 325.41 g/mol, XLogP of 2.73, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-[(3R)-oxolan-3-yl]-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazole-4-carboxamide is sourced from PubChem (CID 129472548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).