2-(furan-2-yl)-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-7-yl)acetamide

C16H21N3O2 — CID 139001083

IUPAC2-(furan-2-yl)-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-7-yl)acetamide
SMILESCC(C)n1cc2c(n1)C(NC(=O)Cc1ccco1)CCC2
InChIInChI=1S/C16H21N3O2/c1-11(2)19-10-12-5-3-7-14(16(12)18-19)17-15(20)9-13-6-4-8-21-13/h4,6,8,10-11,14H,3,5,7,9H2,1-2H3,(H,17,20)
InChIKeyOZAIIZSMVJETKP-UHFFFAOYSA-N
MW287.36 g/mol
LogP2.79
Rot. Bonds4

About 2-(furan-2-yl)-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-7-yl)acetamide

2-(furan-2-yl)-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-7-yl)acetamide (PubChem CID 139001083) has the molecular formula C16H21N3O2 and a molecular weight of 287.36 g/mol. Its IUPAC name is 2-(furan-2-yl)-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-7-yl)acetamide.

Molecular Properties

Compound Name2-(furan-2-yl)-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-7-yl)acetamide
PubChem CID139001083
Molecular FormulaC16H21N3O2
Molecular Weight287.36 g/mol
Exact Mass287.16
IUPAC Name2-(furan-2-yl)-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-7-yl)acetamide
SMILESCC(C)n1cc2c(n1)C(NC(=O)Cc1ccco1)CCC2
InChIInChI=1S/C16H21N3O2/c1-11(2)19-10-12-5-3-7-14(16(12)18-19)17-15(20)9-13-6-4-8-21-13/h4,6,8,10-11,14H,3,5,7,9H2,1-2H3,(H,17,20)
InChIKeyOZAIIZSMVJETKP-UHFFFAOYSA-N
XLogP2.79
TPSA60.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-ethoxy-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-7-yl)acetamide
CID 75484165
1-(4-tert-butylphenyl)-3-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-7-yl)urea
CID 166205955
N-[(7S)-2-propan-2-yl-4,5,6,7-tetrahydroindazol-7-yl]-1-(2,2,2-trifluoroethyl)piperidine-4-carboxamide
CID 97346848
5-methyl-N-[(7R)-2-propan-2-yl-4,5,6,7-tetrahydroindazol-7-yl]-1H-pyrazole-3-carboxamide
CID 97346855
N-cyclopentyl-2-(furan-2-yl)acetamide
CID 110690587
4-[[(2-propan-2-yl-4,5,6,7-tetrahydroindazol-7-yl)amino]methyl]benzonitrile
CID 75484159
N-methyl-2-propan-2-yl-5,6-dihydro-4H-cyclopenta[c]pyrazol-6-amine
CID 112712282
N-(2-cyclopentyl-4,5,6,7-tetrahydroindazol-7-yl)-2-ethoxyacetamide
CID 75484173
N-[(7S)-2-cyclopentyl-4,5,6,7-tetrahydroindazol-7-yl]-2-ethoxyacetamide
CID 97347028
1-cyclopropyl-2-(furan-2-yl)ethanone
CID 83172331
2-(furan-2-yl)-N-piperidin-4-ylacetamide
CID 110484596
4-chloro-2-methyl-5-[(2-propan-2-yl-4,5,6,7-tetrahydroindazol-7-yl)amino]pyridazin-3-one
CID 166206270

Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-7-yl)acetamide?
The IUPAC name of 2-(furan-2-yl)-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-7-yl)acetamide (CID 139001083) is 2-(furan-2-yl)-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-7-yl)acetamide.
What is the SMILES notation for 2-(furan-2-yl)-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-7-yl)acetamide?
The canonical SMILES for 2-(furan-2-yl)-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-7-yl)acetamide is CC(C)n1cc2c(n1)C(NC(=O)Cc1ccco1)CCC2.
What is the InChIKey of 2-(furan-2-yl)-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-7-yl)acetamide?
The InChIKey is OZAIIZSMVJETKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O2/c1-11(2)19-10-12-5-3-7-14(16(12)18-19)17-15(20)9-13-6-4-8-21-13/h4,6,8,10-11,14H,3,5,7,9H2,1-2H3,(H,17,20).
What are the key properties of 2-(furan-2-yl)-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-7-yl)acetamide?
2-(furan-2-yl)-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-7-yl)acetamide has a molecular weight of 287.36 g/mol, XLogP of 2.79, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-7-yl)acetamide is sourced from PubChem (CID 139001083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).