2-(dimethylamino)-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-6-yl)benzamide

C19H26N4O — CID 154778939

IUPAC2-(dimethylamino)-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-6-yl)benzamide
SMILESCC(C)n1cc2c(n1)CC(NC(=O)c1ccccc1N(C)C)CC2
InChIInChI=1S/C19H26N4O/c1-13(2)23-12-14-9-10-15(11-17(14)21-23)20-19(24)16-7-5-6-8-18(16)22(3)4/h5-8,12-13,15H,9-11H2,1-4H3,(H,20,24)
InChIKeyAVYDRGPVDPZSKV-UHFFFAOYSA-N
MW326.44 g/mol
LogP2.82
Rot. Bonds4

About 2-(dimethylamino)-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-6-yl)benzamide

2-(dimethylamino)-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-6-yl)benzamide (PubChem CID 154778939) has the molecular formula C19H26N4O and a molecular weight of 326.44 g/mol. Its IUPAC name is 2-(dimethylamino)-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-6-yl)benzamide.

Molecular Properties

Compound Name2-(dimethylamino)-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-6-yl)benzamide
PubChem CID154778939
Molecular FormulaC19H26N4O
Molecular Weight326.44 g/mol
Exact Mass326.21
IUPAC Name2-(dimethylamino)-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-6-yl)benzamide
SMILESCC(C)n1cc2c(n1)CC(NC(=O)c1ccccc1N(C)C)CC2
InChIInChI=1S/C19H26N4O/c1-13(2)23-12-14-9-10-15(11-17(14)21-23)20-19(24)16-7-5-6-8-18(16)22(3)4/h5-8,12-13,15H,9-11H2,1-4H3,(H,20,24)
InChIKeyAVYDRGPVDPZSKV-UHFFFAOYSA-N
XLogP2.82
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.44
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-2-amino-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-6-yl)propanamide;hydrochloride
CID 119325314
N-[(6S)-2-propan-2-yl-4,5,6,7-tetrahydroindazol-6-yl]thieno[2,3-b]pyridine-2-carboxamide
CID 164639566
5-ethyl-2-hydroxy-N-(2-methyl-4,5,6,7-tetrahydroindazol-6-yl)benzamide
CID 166306565
2-(dimethylamino)-N-[4-[2-[7-(2-methylpropanoyl)-1,2,4,5-tetrahydro-3-benzazepin-3-yl]ethyl]cyclohexyl]benzamide
CID 11684571
2-methyl-N-[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]pyridine-3-carboxamide
CID 10199216
3-methyl-1-propyl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazole-4-carboxamide
CID 131908727
2-bromo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)benzamide
CID 60630141
2-(dimethylamino)-N-(4-methylpiperazin-1-yl)benzamide
CID 110463540
2-(dimethylamino)-N-[(3R)-5-oxo-1-(3-phenylpropyl)pyrrolidin-3-yl]benzamide
CID 26392506
N-[4-[(4-chlorophenyl)methylcarbamoylamino]cyclohexyl]-2-(dimethylamino)benzamide
CID 166834763
2-(dimethylamino)-N-methyl-N-(1-methylpiperidin-4-yl)benzamide
CID 110463573
2-methyl-N-[(2R)-8-(4-methylpiperazin-1-yl)-1,2,3,4-tetrahydronaphthalen-2-yl]benzamide
CID 54135218

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-6-yl)benzamide?
The IUPAC name of 2-(dimethylamino)-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-6-yl)benzamide (CID 154778939) is 2-(dimethylamino)-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-6-yl)benzamide.
What is the SMILES notation for 2-(dimethylamino)-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-6-yl)benzamide?
The canonical SMILES for 2-(dimethylamino)-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-6-yl)benzamide is CC(C)n1cc2c(n1)CC(NC(=O)c1ccccc1N(C)C)CC2.
What is the InChIKey of 2-(dimethylamino)-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-6-yl)benzamide?
The InChIKey is AVYDRGPVDPZSKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4O/c1-13(2)23-12-14-9-10-15(11-17(14)21-23)20-19(24)16-7-5-6-8-18(16)22(3)4/h5-8,12-13,15H,9-11H2,1-4H3,(H,20,24).
What are the key properties of 2-(dimethylamino)-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-6-yl)benzamide?
2-(dimethylamino)-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-6-yl)benzamide has a molecular weight of 326.44 g/mol, XLogP of 2.82, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-6-yl)benzamide is sourced from PubChem (CID 154778939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).