5-methyl-N-[[2-methyl-3-[4-[2-methyl-3-[(5-methyl-1H-pyrazole-3-carbonyl)hydrazinylidene]prop-1-enyl]phenyl]prop-2-enylidene]amino]-1H-pyrazole-3-carboxamide

C24H26N8O2 — CID 3097199

IUPAC5-methyl-N-[[2-methyl-3-[4-[2-methyl-3-[(5-methyl-1H-pyrazole-3-carbonyl)hydrazinylidene]prop-1-enyl]phenyl]prop-2-enylidene]amino]-1H-pyrazole-3-carboxamide
SMILESCC(C=NNC(=O)c1cc(C)[nH]n1)=Cc1ccc(C=C(C)C=NNC(=O)c2cc(C)[nH]n2)cc1
InChIInChI=1S/C24H26N8O2/c1-15(13-25-31-23(33)21-11-17(3)27-29-21)9-19-5-7-20(8-6-19)10-16(2)14-26-32-24(34)22-12-18(4)28-30-22/h5-14H,1-4H3,(H,27,29)(H,28,30)(H,31,33)(H,32,34)
InChIKeyFMFWAOGTNVPRAF-UHFFFAOYSA-N
MW458.53 g/mol
LogP3.39
Rot. Bonds8

About 5-methyl-N-[[2-methyl-3-[4-[2-methyl-3-[(5-methyl-1H-pyrazole-3-carbonyl)hydrazinylidene]prop-1-enyl]phenyl]prop-2-enylidene]amino]-1H-pyrazole-3-carboxamide

5-methyl-N-[[2-methyl-3-[4-[2-methyl-3-[(5-methyl-1H-pyrazole-3-carbonyl)hydrazinylidene]prop-1-enyl]phenyl]prop-2-enylidene]amino]-1H-pyrazole-3-carboxamide (PubChem CID 3097199) has the molecular formula C24H26N8O2 and a molecular weight of 458.53 g/mol. Its IUPAC name is 5-methyl-N-[[2-methyl-3-[4-[2-methyl-3-[(5-methyl-1H-pyrazole-3-carbonyl)hydrazinylidene]prop-1-enyl]phenyl]prop-2-enylidene]amino]-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound Name5-methyl-N-[[2-methyl-3-[4-[2-methyl-3-[(5-methyl-1H-pyrazole-3-carbonyl)hydrazinylidene]prop-1-enyl]phenyl]prop-2-enylidene]amino]-1H-pyrazole-3-carboxamide
PubChem CID3097199
Molecular FormulaC24H26N8O2
Molecular Weight458.53 g/mol
Exact Mass458.22
IUPAC Name5-methyl-N-[[2-methyl-3-[4-[2-methyl-3-[(5-methyl-1H-pyrazole-3-carbonyl)hydrazinylidene]prop-1-enyl]phenyl]prop-2-enylidene]amino]-1H-pyrazole-3-carboxamide
SMILESCC(C=NNC(=O)c1cc(C)[nH]n1)=Cc1ccc(C=C(C)C=NNC(=O)c2cc(C)[nH]n2)cc1
InChIInChI=1S/C24H26N8O2/c1-15(13-25-31-23(33)21-11-17(3)27-29-21)9-19-5-7-20(8-6-19)10-16(2)14-26-32-24(34)22-12-18(4)28-30-22/h5-14H,1-4H3,(H,27,29)(H,28,30)(H,31,33)(H,32,34)
InChIKeyFMFWAOGTNVPRAF-UHFFFAOYSA-N
XLogP3.39
TPSA140.28 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500458.53
LogP ≤ 53.39
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 5-methyl-N-[[2-methyl-3-[4-[2-methyl-3-[(5-methyl-1H-pyrazole-3-carbonyl)hydrazinylidene]prop-1-enyl]phenyl]prop-2-enylidene]amino]-1H-pyrazole-3-carboxamide with MolForge

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

Launch Full Analysis

Related Compounds

5-(1-adamantyl)-N-[(2-methyl-3-phenylprop-2-enylidene)amino]-1H-pyrazole-3-carboxamide
CID 2868822
5-methyl-N-[(4-nitrophenyl)methylideneamino]-1H-pyrazole-3-carboxamide
CID 760769
N-[(Z)-(2,4-dihydroxyphenyl)methylideneamino]-5-methyl-1H-pyrazole-3-carboxamide
CID 136728469
N-[(3-fluorophenyl)methylideneamino]-5-methyl-1H-pyrazole-3-carboxamide
CID 5105214
2-[(E)-[(5-methyl-1H-pyrazole-3-carbonyl)hydrazinylidene]methyl]benzoic acid
CID 6890868
[4-[[(5-methyl-1H-pyrazole-3-carbonyl)hydrazinylidene]methyl]phenyl] furan-2-carboxylate
CID 4675740
N-[(Z)-(2,5-dimethoxyphenyl)methylideneamino]-5-methyl-1H-pyrazole-3-carboxamide
CID 5402501
N-[(Z)-anthracen-9-ylmethylideneamino]-5-methyl-1H-pyrazole-3-carboxamide
CID 5404758
[4-[[(5-methyl-1H-pyrazole-3-carbonyl)hydrazinylidene]methyl]phenyl] 2-iodobenzoate
CID 3736032
5-tert-butyl-N-[(E)-[(Z)-2-chloro-3-phenylprop-2-enylidene]amino]-1H-pyrazole-3-carboxamide
CID 44722262
[4-[[(5-methyl-1H-pyrazole-3-carbonyl)hydrazinylidene]methyl]phenyl] 2,4-dichlorobenzoate
CID 5009388
3-(4-bromophenyl)-N-[(Z)-[(E)-2-methyl-3-phenylprop-2-enylidene]amino]-1H-pyrazole-5-carboxamide
CID 6002219

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-[[2-methyl-3-[4-[2-methyl-3-[(5-methyl-1H-pyrazole-3-carbonyl)hydrazinylidene]prop-1-enyl]phenyl]prop-2-enylidene]amino]-1H-pyrazole-3-carboxamide?
The IUPAC name of 5-methyl-N-[[2-methyl-3-[4-[2-methyl-3-[(5-methyl-1H-pyrazole-3-carbonyl)hydrazinylidene]prop-1-enyl]phenyl]prop-2-enylidene]amino]-1H-pyrazole-3-carboxamide (CID 3097199) is 5-methyl-N-[[2-methyl-3-[4-[2-methyl-3-[(5-methyl-1H-pyrazole-3-carbonyl)hydrazinylidene]prop-1-enyl]phenyl]prop-2-enylidene]amino]-1H-pyrazole-3-carboxamide.
What is the SMILES notation for 5-methyl-N-[[2-methyl-3-[4-[2-methyl-3-[(5-methyl-1H-pyrazole-3-carbonyl)hydrazinylidene]prop-1-enyl]phenyl]prop-2-enylidene]amino]-1H-pyrazole-3-carboxamide?
The canonical SMILES for 5-methyl-N-[[2-methyl-3-[4-[2-methyl-3-[(5-methyl-1H-pyrazole-3-carbonyl)hydrazinylidene]prop-1-enyl]phenyl]prop-2-enylidene]amino]-1H-pyrazole-3-carboxamide is CC(C=NNC(=O)c1cc(C)[nH]n1)=Cc1ccc(C=C(C)C=NNC(=O)c2cc(C)[nH]n2)cc1.
What is the InChIKey of 5-methyl-N-[[2-methyl-3-[4-[2-methyl-3-[(5-methyl-1H-pyrazole-3-carbonyl)hydrazinylidene]prop-1-enyl]phenyl]prop-2-enylidene]amino]-1H-pyrazole-3-carboxamide?
The InChIKey is FMFWAOGTNVPRAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N8O2/c1-15(13-25-31-23(33)21-11-17(3)27-29-21)9-19-5-7-20(8-6-19)10-16(2)14-26-32-24(34)22-12-18(4)28-30-22/h5-14H,1-4H3,(H,27,29)(H,28,30)(H,31,33)(H,32,34).
What are the key properties of 5-methyl-N-[[2-methyl-3-[4-[2-methyl-3-[(5-methyl-1H-pyrazole-3-carbonyl)hydrazinylidene]prop-1-enyl]phenyl]prop-2-enylidene]amino]-1H-pyrazole-3-carboxamide?
5-methyl-N-[[2-methyl-3-[4-[2-methyl-3-[(5-methyl-1H-pyrazole-3-carbonyl)hydrazinylidene]prop-1-enyl]phenyl]prop-2-enylidene]amino]-1H-pyrazole-3-carboxamide has a molecular weight of 458.53 g/mol, XLogP of 3.39, 8 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-[[2-methyl-3-[4-[2-methyl-3-[(5-methyl-1H-pyrazole-3-carbonyl)hydrazinylidene]prop-1-enyl]phenyl]prop-2-enylidene]amino]-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 3097199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).