1-carbazol-9-yl-2-(3,5-dimethylpyrazol-1-yl)ethanone

C19H17N3O — CID 3119235

IUPAC1-carbazol-9-yl-2-(3,5-dimethylpyrazol-1-yl)ethanone
SMILESCc1cc(C)n(CC(=O)n2c3ccccc3c3ccccc32)n1
InChIInChI=1S/C19H17N3O/c1-13-11-14(2)21(20-13)12-19(23)22-17-9-5-3-7-15(17)16-8-4-6-10-18(16)22/h3-11H,12H2,1-2H3
InChIKeyYVIPQPMEQPBYGJ-UHFFFAOYSA-N
MW303.37 g/mol
LogP3.95
Rot. Bonds2

About 1-carbazol-9-yl-2-(3,5-dimethylpyrazol-1-yl)ethanone

1-carbazol-9-yl-2-(3,5-dimethylpyrazol-1-yl)ethanone (PubChem CID 3119235) has the molecular formula C19H17N3O and a molecular weight of 303.37 g/mol. Its IUPAC name is 1-carbazol-9-yl-2-(3,5-dimethylpyrazol-1-yl)ethanone.

Molecular Properties

Compound Name1-carbazol-9-yl-2-(3,5-dimethylpyrazol-1-yl)ethanone
PubChem CID3119235
Molecular FormulaC19H17N3O
Molecular Weight303.37 g/mol
Exact Mass303.14
IUPAC Name1-carbazol-9-yl-2-(3,5-dimethylpyrazol-1-yl)ethanone
SMILESCc1cc(C)n(CC(=O)n2c3ccccc3c3ccccc32)n1
InChIInChI=1S/C19H17N3O/c1-13-11-14(2)21(20-13)12-19(23)22-17-9-5-3-7-15(17)16-8-4-6-10-18(16)22/h3-11H,12H2,1-2H3
InChIKeyYVIPQPMEQPBYGJ-UHFFFAOYSA-N
XLogP3.95
TPSA39.82 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.37
LogP ≤ 53.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-{[2-(1H-indazol-3-yl)-1H-indol-5-yl]methyl}piperazin-1-yl)ethan-1-one
CID 135559055
2-[3-(3-Fluorophenyl)indazol-1-yl]-1-piperidin-1-ylethanone
CID 56837421
N-[[5-(2,6-difluorophenyl)-2-pyridinyl]methyl]-2-(12-fluoro-5,6,16-triazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),2,4,10(15),11,13-hexaen-16-yl)acetamide
CID 121277778
9-(piperidin-1-ylacetyl)-9H-carbazole
CID 3510891
2-(1H-indazol-1-yl)-N-(4-isopropylphenyl)acetamide
CID 20885372
N-(9-ethylcarbazol-3-yl)-2-pyrrolidin-1-ylacetamide
CID 2574547
1-[5-(1-Methyl-1H-indol-3-yl)-3-phenyl-4,5-dihydro-pyrazol-1-yl]-ethanone
CID 3722411
2-Dimethylamino-N-(9-ethyl-9H-carbazol-3-yl)-acetamide
CID 9922187
9H-Carbazole-9-acetamide, N,N-diethyl-
CID 11780929
4-(1-methyl-1H-indol-2-yl)-1-(1-(2-(pyrrolidin-1-yl)ethyl)-1H-indazol-5-yl)pyridin-2(1H)-one
CID 25205152
4-(1-methyl-1H-indol-5-yl)-1-(1-(2-(pyrrolidin-1-yl)ethyl)-1H-indazol-5-yl)pyridin-2(1H)-one
CID 25205321
[2-[(3,5-Dimethyl-1-phenylpyrazol-4-yl)amino]-2-oxoethyl] 2-(2-methylindol-1-yl)acetate
CID 41583852

Frequently Asked Questions

What is the IUPAC name of 1-carbazol-9-yl-2-(3,5-dimethylpyrazol-1-yl)ethanone?
The IUPAC name of 1-carbazol-9-yl-2-(3,5-dimethylpyrazol-1-yl)ethanone (CID 3119235) is 1-carbazol-9-yl-2-(3,5-dimethylpyrazol-1-yl)ethanone.
What is the SMILES notation for 1-carbazol-9-yl-2-(3,5-dimethylpyrazol-1-yl)ethanone?
The canonical SMILES for 1-carbazol-9-yl-2-(3,5-dimethylpyrazol-1-yl)ethanone is Cc1cc(C)n(CC(=O)n2c3ccccc3c3ccccc32)n1.
What is the InChIKey of 1-carbazol-9-yl-2-(3,5-dimethylpyrazol-1-yl)ethanone?
The InChIKey is YVIPQPMEQPBYGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3O/c1-13-11-14(2)21(20-13)12-19(23)22-17-9-5-3-7-15(17)16-8-4-6-10-18(16)22/h3-11H,12H2,1-2H3.
What are the key properties of 1-carbazol-9-yl-2-(3,5-dimethylpyrazol-1-yl)ethanone?
1-carbazol-9-yl-2-(3,5-dimethylpyrazol-1-yl)ethanone has a molecular weight of 303.37 g/mol, XLogP of 3.95, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-carbazol-9-yl-2-(3,5-dimethylpyrazol-1-yl)ethanone is sourced from PubChem (CID 3119235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).