N'-benzoyl-N-tert-butyl-3,5-dichloro-N'-methylbenzohydrazide

C19H20Cl2N2O2 — CID 19752979

IUPACN'-benzoyl-N-tert-butyl-3,5-dichloro-N'-methylbenzohydrazide
SMILESCN(C(=O)c1ccccc1)N(C(=O)c1cc(Cl)cc(Cl)c1)C(C)(C)C
InChIInChI=1S/C19H20Cl2N2O2/c1-19(2,3)23(18(25)14-10-15(20)12-16(21)11-14)22(4)17(24)13-8-6-5-7-9-13/h5-12H,1-4H3
InChIKeyJSVJLRXJEHSDOP-UHFFFAOYSA-N
MW379.29 g/mol
LogP4.92
Rot. Bonds2

About N'-benzoyl-N-tert-butyl-3,5-dichloro-N'-methylbenzohydrazide

N'-benzoyl-N-tert-butyl-3,5-dichloro-N'-methylbenzohydrazide (PubChem CID 19752979) has the molecular formula C19H20Cl2N2O2 and a molecular weight of 379.29 g/mol. Its IUPAC name is N'-benzoyl-N-tert-butyl-3,5-dichloro-N'-methylbenzohydrazide.

Molecular Properties

Compound NameN'-benzoyl-N-tert-butyl-3,5-dichloro-N'-methylbenzohydrazide
PubChem CID19752979
Molecular FormulaC19H20Cl2N2O2
Molecular Weight379.29 g/mol
Exact Mass378.09
IUPAC NameN'-benzoyl-N-tert-butyl-3,5-dichloro-N'-methylbenzohydrazide
SMILESCN(C(=O)c1ccccc1)N(C(=O)c1cc(Cl)cc(Cl)c1)C(C)(C)C
InChIInChI=1S/C19H20Cl2N2O2/c1-19(2,3)23(18(25)14-10-15(20)12-16(21)11-14)22(4)17(24)13-8-6-5-7-9-13/h5-12H,1-4H3
InChIKeyJSVJLRXJEHSDOP-UHFFFAOYSA-N
XLogP4.92
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.29
LogP ≤ 54.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N'-tert-butyl-4-chloro-N'-(4-chlorobenzoyl)-N-methylbenzohydrazide
CID 19752746
3,5-dichloro-N-methyl-N-phenylbenzamide;ethane
CID 156791859
N'-benzoyl-N'-tert-butyl-N-ethylbenzohydrazide
CID 19752906
acetic acid;N-tert-butyl-N-hydroxybenzamide
CID 162308139
N'-tert-butyl-N,4-dimethyl-N'-[4-(trifluoromethyl)benzoyl]benzohydrazide
CID 19752729
N'-benzoyl-N-tert-butyl-3-methoxy-N'-methyl-2-nitrobenzohydrazide
CID 19752907
iodomethyl N-benzoyl-N-[tert-butyl-(4-chlorobenzoyl)amino]carbamate
CID 70215513
N'-tert-butyl-2,4-dichloro-N-methyl-N'-[4-(trifluoromethoxy)benzoyl]benzohydrazide
CID 19752817
N,N'-dimethyl-N'-(trifluoromethyl)benzohydrazide
CID 174890331
N-(3-amino-2,2-dimethylpropyl)-3,5-dichloro-N-methylbenzamide
CID 79653062
N-bromo-N-tert-butylbenzamide
CID 141466989
N'-tert-butyl-3,5-dichloro-N'-(4-chlorobenzoyl)benzohydrazide
CID 23164437

Frequently Asked Questions

What is the IUPAC name of N'-benzoyl-N-tert-butyl-3,5-dichloro-N'-methylbenzohydrazide?
The IUPAC name of N'-benzoyl-N-tert-butyl-3,5-dichloro-N'-methylbenzohydrazide (CID 19752979) is N'-benzoyl-N-tert-butyl-3,5-dichloro-N'-methylbenzohydrazide.
What is the SMILES notation for N'-benzoyl-N-tert-butyl-3,5-dichloro-N'-methylbenzohydrazide?
The canonical SMILES for N'-benzoyl-N-tert-butyl-3,5-dichloro-N'-methylbenzohydrazide is CN(C(=O)c1ccccc1)N(C(=O)c1cc(Cl)cc(Cl)c1)C(C)(C)C.
What is the InChIKey of N'-benzoyl-N-tert-butyl-3,5-dichloro-N'-methylbenzohydrazide?
The InChIKey is JSVJLRXJEHSDOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20Cl2N2O2/c1-19(2,3)23(18(25)14-10-15(20)12-16(21)11-14)22(4)17(24)13-8-6-5-7-9-13/h5-12H,1-4H3.
What are the key properties of N'-benzoyl-N-tert-butyl-3,5-dichloro-N'-methylbenzohydrazide?
N'-benzoyl-N-tert-butyl-3,5-dichloro-N'-methylbenzohydrazide has a molecular weight of 379.29 g/mol, XLogP of 4.92, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-benzoyl-N-tert-butyl-3,5-dichloro-N'-methylbenzohydrazide is sourced from PubChem (CID 19752979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).