2,5-dimethyl-N-[(4S)-1-methyl-4,5,6,7-tetrahydroindazol-4-yl]furan-3-carboxamide

C15H19N3O2 — CID 94187673

IUPAC2,5-dimethyl-N-[(4S)-1-methyl-4,5,6,7-tetrahydroindazol-4-yl]furan-3-carboxamide
SMILESCc1cc(C(=O)N[C@H]2CCCc3c2cnn3C)c(C)o1
InChIInChI=1S/C15H19N3O2/c1-9-7-11(10(2)20-9)15(19)17-13-5-4-6-14-12(13)8-16-18(14)3/h7-8,13H,4-6H2,1-3H3,(H,17,19)/t13-/m0/s1
InChIKeyAUPMUKQVGQYRCW-ZDUSSCGKSA-N
MW273.34 g/mol
LogP2.44
Rot. Bonds2

About 2,5-dimethyl-N-[(4S)-1-methyl-4,5,6,7-tetrahydroindazol-4-yl]furan-3-carboxamide

2,5-dimethyl-N-[(4S)-1-methyl-4,5,6,7-tetrahydroindazol-4-yl]furan-3-carboxamide (PubChem CID 94187673) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is 2,5-dimethyl-N-[(4S)-1-methyl-4,5,6,7-tetrahydroindazol-4-yl]furan-3-carboxamide.

Molecular Properties

Compound Name2,5-dimethyl-N-[(4S)-1-methyl-4,5,6,7-tetrahydroindazol-4-yl]furan-3-carboxamide
PubChem CID94187673
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC Name2,5-dimethyl-N-[(4S)-1-methyl-4,5,6,7-tetrahydroindazol-4-yl]furan-3-carboxamide
SMILESCc1cc(C(=O)N[C@H]2CCCc3c2cnn3C)c(C)o1
InChIInChI=1S/C15H19N3O2/c1-9-7-11(10(2)20-9)15(19)17-13-5-4-6-14-12(13)8-16-18(14)3/h7-8,13H,4-6H2,1-3H3,(H,17,19)/t13-/m0/s1
InChIKeyAUPMUKQVGQYRCW-ZDUSSCGKSA-N
XLogP2.44
TPSA60.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2,5-dimethyl-N-[(4S)-1-methyl-4,5,6,7-tetrahydroindazol-4-yl]furan-3-carboxamide with MolForge

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Related Compounds

6-methyl-N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)-4-oxo-1H-pyridine-3-carboxamide
CID 103696348
3-hydroxy-N-[(4R)-1-methyl-4,5,6,7-tetrahydroindazol-4-yl]-5,6,7,8-tetrahydronaphthalene-2-carboxamide
CID 95159871
2-amino-N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)benzamide
CID 61213666
2-amino-4-bromo-N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)benzamide
CID 79704714
5-bromo-2-fluoro-N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)benzamide
CID 43063208
N-[(4S)-1-methyl-4,5,6,7-tetrahydroindazol-4-yl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
CID 94145039
N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)-5-propan-2-yl-1,2-oxazole-3-carboxamide
CID 56731507
1-(5-methyl-1,2-oxazol-3-yl)-3-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)urea
CID 47026059
N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)cyclopropanecarboxamide
CID 42958313
4-ethyl-5-methyl-N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)thiophene-2-carboxamide
CID 42956258
1,6-dimethyl-N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)-3-oxo-2H-pyrazolo[3,4-b]pyridine-4-carboxamide
CID 43073922
N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)pyridine-2-carboxamide
CID 47027925

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-N-[(4S)-1-methyl-4,5,6,7-tetrahydroindazol-4-yl]furan-3-carboxamide?
The IUPAC name of 2,5-dimethyl-N-[(4S)-1-methyl-4,5,6,7-tetrahydroindazol-4-yl]furan-3-carboxamide (CID 94187673) is 2,5-dimethyl-N-[(4S)-1-methyl-4,5,6,7-tetrahydroindazol-4-yl]furan-3-carboxamide.
What is the SMILES notation for 2,5-dimethyl-N-[(4S)-1-methyl-4,5,6,7-tetrahydroindazol-4-yl]furan-3-carboxamide?
The canonical SMILES for 2,5-dimethyl-N-[(4S)-1-methyl-4,5,6,7-tetrahydroindazol-4-yl]furan-3-carboxamide is Cc1cc(C(=O)N[C@H]2CCCc3c2cnn3C)c(C)o1.
What is the InChIKey of 2,5-dimethyl-N-[(4S)-1-methyl-4,5,6,7-tetrahydroindazol-4-yl]furan-3-carboxamide?
The InChIKey is AUPMUKQVGQYRCW-ZDUSSCGKSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-9-7-11(10(2)20-9)15(19)17-13-5-4-6-14-12(13)8-16-18(14)3/h7-8,13H,4-6H2,1-3H3,(H,17,19)/t13-/m0/s1.
What are the key properties of 2,5-dimethyl-N-[(4S)-1-methyl-4,5,6,7-tetrahydroindazol-4-yl]furan-3-carboxamide?
2,5-dimethyl-N-[(4S)-1-methyl-4,5,6,7-tetrahydroindazol-4-yl]furan-3-carboxamide has a molecular weight of 273.34 g/mol, XLogP of 2.44, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-N-[(4S)-1-methyl-4,5,6,7-tetrahydroindazol-4-yl]furan-3-carboxamide is sourced from PubChem (CID 94187673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).