3-(5,5-dimethyl-3-phenyl-4H-pyrazolo[4,5-a]carbazol-10-yl)-N,N-dimethylpropan-1-amine

C26H30N4 — CID 23908960

IUPAC3-(5,5-dimethyl-3-phenyl-4H-pyrazolo[4,5-a]carbazol-10-yl)-N,N-dimethylpropan-1-amine
SMILESCN(C)CCCn1c2c(c3ccccc31)C(C)(C)Cc1c-2cnn1-c1ccccc1
InChIInChI=1S/C26H30N4/c1-26(2)17-23-21(18-27-30(23)19-11-6-5-7-12-19)25-24(26)20-13-8-9-14-22(20)29(25)16-10-15-28(3)4/h5-9,11-14,18H,10,15-17H2,1-4H3
InChIKeyBFMHRRZFLWIXES-UHFFFAOYSA-N
MW398.55 g/mol
LogP5.28
Rot. Bonds5

About 3-(5,5-dimethyl-3-phenyl-4H-pyrazolo[4,5-a]carbazol-10-yl)-N,N-dimethylpropan-1-amine

3-(5,5-dimethyl-3-phenyl-4H-pyrazolo[4,5-a]carbazol-10-yl)-N,N-dimethylpropan-1-amine (PubChem CID 23908960) has the molecular formula C26H30N4 and a molecular weight of 398.55 g/mol. Its IUPAC name is 3-(5,5-dimethyl-3-phenyl-4H-pyrazolo[4,5-a]carbazol-10-yl)-N,N-dimethylpropan-1-amine.

Molecular Properties

Compound Name3-(5,5-dimethyl-3-phenyl-4H-pyrazolo[4,5-a]carbazol-10-yl)-N,N-dimethylpropan-1-amine
PubChem CID23908960
Molecular FormulaC26H30N4
Molecular Weight398.55 g/mol
Exact Mass398.25
IUPAC Name3-(5,5-dimethyl-3-phenyl-4H-pyrazolo[4,5-a]carbazol-10-yl)-N,N-dimethylpropan-1-amine
SMILESCN(C)CCCn1c2c(c3ccccc31)C(C)(C)Cc1c-2cnn1-c1ccccc1
InChIInChI=1S/C26H30N4/c1-26(2)17-23-21(18-27-30(23)19-11-6-5-7-12-19)25-24(26)20-13-8-9-14-22(20)29(25)16-10-15-28(3)4/h5-9,11-14,18H,10,15-17H2,1-4H3
InChIKeyBFMHRRZFLWIXES-UHFFFAOYSA-N
XLogP5.28
TPSA25.99 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500398.55
LogP ≤ 55.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 3-(5,5-dimethyl-3-phenyl-4H-pyrazolo[4,5-a]carbazol-10-yl)-N,N-dimethylpropan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-(5,5-dimethyl-3-phenyl-4H-pyrazolo[4,5-a]carbazol-10-yl)-N,N-dimethylpropan-1-amine?
The IUPAC name of 3-(5,5-dimethyl-3-phenyl-4H-pyrazolo[4,5-a]carbazol-10-yl)-N,N-dimethylpropan-1-amine (CID 23908960) is 3-(5,5-dimethyl-3-phenyl-4H-pyrazolo[4,5-a]carbazol-10-yl)-N,N-dimethylpropan-1-amine.
What is the SMILES notation for 3-(5,5-dimethyl-3-phenyl-4H-pyrazolo[4,5-a]carbazol-10-yl)-N,N-dimethylpropan-1-amine?
The canonical SMILES for 3-(5,5-dimethyl-3-phenyl-4H-pyrazolo[4,5-a]carbazol-10-yl)-N,N-dimethylpropan-1-amine is CN(C)CCCn1c2c(c3ccccc31)C(C)(C)Cc1c-2cnn1-c1ccccc1.
What is the InChIKey of 3-(5,5-dimethyl-3-phenyl-4H-pyrazolo[4,5-a]carbazol-10-yl)-N,N-dimethylpropan-1-amine?
The InChIKey is BFMHRRZFLWIXES-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H30N4/c1-26(2)17-23-21(18-27-30(23)19-11-6-5-7-12-19)25-24(26)20-13-8-9-14-22(20)29(25)16-10-15-28(3)4/h5-9,11-14,18H,10,15-17H2,1-4H3.
What are the key properties of 3-(5,5-dimethyl-3-phenyl-4H-pyrazolo[4,5-a]carbazol-10-yl)-N,N-dimethylpropan-1-amine?
3-(5,5-dimethyl-3-phenyl-4H-pyrazolo[4,5-a]carbazol-10-yl)-N,N-dimethylpropan-1-amine has a molecular weight of 398.55 g/mol, XLogP of 5.28, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5,5-dimethyl-3-phenyl-4H-pyrazolo[4,5-a]carbazol-10-yl)-N,N-dimethylpropan-1-amine is sourced from PubChem (CID 23908960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).