1-[2-[[1-(4-chlorophenyl)pyrazol-3-yl]oxymethyl]-3-cyclopropylphenyl]-1-methylhydrazine

C20H21ClN4O — CID 134293404

IUPAC1-[2-[[1-(4-chlorophenyl)pyrazol-3-yl]oxymethyl]-3-cyclopropylphenyl]-1-methylhydrazine
SMILESCN(N)c1cccc(C2CC2)c1COc1ccn(-c2ccc(Cl)cc2)n1
InChIInChI=1S/C20H21ClN4O/c1-24(22)19-4-2-3-17(14-5-6-14)18(19)13-26-20-11-12-25(23-20)16-9-7-15(21)8-10-16/h2-4,7-12,14H,5-6,13,22H2,1H3
InChIKeyUOBDDVMKXUSPMX-UHFFFAOYSA-N
MW368.87 g/mol
LogP4.29
Rot. Bonds6

About 1-[2-[[1-(4-chlorophenyl)pyrazol-3-yl]oxymethyl]-3-cyclopropylphenyl]-1-methylhydrazine

1-[2-[[1-(4-chlorophenyl)pyrazol-3-yl]oxymethyl]-3-cyclopropylphenyl]-1-methylhydrazine (PubChem CID 134293404) has the molecular formula C20H21ClN4O and a molecular weight of 368.87 g/mol. Its IUPAC name is 1-[2-[[1-(4-chlorophenyl)pyrazol-3-yl]oxymethyl]-3-cyclopropylphenyl]-1-methylhydrazine.

Molecular Properties

Compound Name1-[2-[[1-(4-chlorophenyl)pyrazol-3-yl]oxymethyl]-3-cyclopropylphenyl]-1-methylhydrazine
PubChem CID134293404
Molecular FormulaC20H21ClN4O
Molecular Weight368.87 g/mol
Exact Mass368.14
IUPAC Name1-[2-[[1-(4-chlorophenyl)pyrazol-3-yl]oxymethyl]-3-cyclopropylphenyl]-1-methylhydrazine
SMILESCN(N)c1cccc(C2CC2)c1COc1ccn(-c2ccc(Cl)cc2)n1
InChIInChI=1S/C20H21ClN4O/c1-24(22)19-4-2-3-17(14-5-6-14)18(19)13-26-20-11-12-25(23-20)16-9-7-15(21)8-10-16/h2-4,7-12,14H,5-6,13,22H2,1H3
InChIKeyUOBDDVMKXUSPMX-UHFFFAOYSA-N
XLogP4.29
TPSA56.31 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.87
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

1-[2-[[1-(4-chlorophenyl)pyrazol-3-yl]oxymethyl]-3-methylphenyl]-1-methylhydrazine
CID 155217844
1-[2-[[1-(4-chlorophenyl)pyrazol-3-yl]oxymethyl]-3-ethenylphenyl]-1-methylhydrazine
CID 155217759
1-[2-[(5-bromo-6-methyl-2-pyridinyl)oxymethyl]-3-cyclopropylphenyl]-1-methylhydrazine
CID 134548036
1-methyl-1-[3-methyl-2-[[1-(2,3,4,5,6-pentafluorophenyl)pyrazol-3-yl]oxymethyl]phenyl]hydrazine
CID 155217757
N-[2-[[1-(4-chlorophenyl)pyrazol-3-yl]oxymethyl]phenyl]-N-phenylhydroxylamine
CID 172560765
1-[3-cyclopropyl-2-[(2-methyl-3-pyridinyl)oxymethyl]phenyl]-1-methylhydrazine;formohydrazide
CID 144784323
1-methyl-1-[3-methyl-2-[[1-(1,3-thiazol-2-yl)pyrazol-3-yl]oxymethyl]phenyl]hydrazine
CID 138495663
1-[2-[(5-chloro-2-fluorophenyl)sulfanylmethyl]-3-cyclopropylphenyl]-1-methylhydrazine
CID 144933230
3-[(2-bromophenyl)methoxy]-1-(4-chlorophenyl)pyrazole
CID 67042683
methyl N-[2-[[1-(4-chlorophenyl)pyrazol-3-yl]oxymethyl]phenyl]-N-methoxycarbamate
CID 6422843
1-methyl-1-[3-methyl-2-[[1-(2-propan-2-yloxyphenyl)pyrazol-3-yl]oxymethyl]phenyl]hydrazine
CID 155217765
1,3-diamino-1-[2-[[1-(4-bromophenyl)pyrazol-3-yl]oxymethyl]-3-chlorophenyl]urea
CID 155217756

Frequently Asked Questions

What is the IUPAC name of 1-[2-[[1-(4-chlorophenyl)pyrazol-3-yl]oxymethyl]-3-cyclopropylphenyl]-1-methylhydrazine?
The IUPAC name of 1-[2-[[1-(4-chlorophenyl)pyrazol-3-yl]oxymethyl]-3-cyclopropylphenyl]-1-methylhydrazine (CID 134293404) is 1-[2-[[1-(4-chlorophenyl)pyrazol-3-yl]oxymethyl]-3-cyclopropylphenyl]-1-methylhydrazine.
What is the SMILES notation for 1-[2-[[1-(4-chlorophenyl)pyrazol-3-yl]oxymethyl]-3-cyclopropylphenyl]-1-methylhydrazine?
The canonical SMILES for 1-[2-[[1-(4-chlorophenyl)pyrazol-3-yl]oxymethyl]-3-cyclopropylphenyl]-1-methylhydrazine is CN(N)c1cccc(C2CC2)c1COc1ccn(-c2ccc(Cl)cc2)n1.
What is the InChIKey of 1-[2-[[1-(4-chlorophenyl)pyrazol-3-yl]oxymethyl]-3-cyclopropylphenyl]-1-methylhydrazine?
The InChIKey is UOBDDVMKXUSPMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21ClN4O/c1-24(22)19-4-2-3-17(14-5-6-14)18(19)13-26-20-11-12-25(23-20)16-9-7-15(21)8-10-16/h2-4,7-12,14H,5-6,13,22H2,1H3.
What are the key properties of 1-[2-[[1-(4-chlorophenyl)pyrazol-3-yl]oxymethyl]-3-cyclopropylphenyl]-1-methylhydrazine?
1-[2-[[1-(4-chlorophenyl)pyrazol-3-yl]oxymethyl]-3-cyclopropylphenyl]-1-methylhydrazine has a molecular weight of 368.87 g/mol, XLogP of 4.29, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[[1-(4-chlorophenyl)pyrazol-3-yl]oxymethyl]-3-cyclopropylphenyl]-1-methylhydrazine is sourced from PubChem (CID 134293404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).