1-(2,4-dichlorophenyl)-2-methylpyrazolidine

C10H12Cl2N2 — CID 59602826

IUPAC1-(2,4-dichlorophenyl)-2-methylpyrazolidine
SMILESCN1CCCN1c1ccc(Cl)cc1Cl
InChIInChI=1S/C10H12Cl2N2/c1-13-5-2-6-14(13)10-4-3-8(11)7-9(10)12/h3-4,7H,2,5-6H2,1H3
InChIKeyTWEIAPGWWSCXCC-UHFFFAOYSA-N
MW231.13 g/mol
LogP3.05
Rot. Bonds1

About 1-(2,4-dichlorophenyl)-2-methylpyrazolidine

1-(2,4-dichlorophenyl)-2-methylpyrazolidine (PubChem CID 59602826) has the molecular formula C10H12Cl2N2 and a molecular weight of 231.13 g/mol. Its IUPAC name is 1-(2,4-dichlorophenyl)-2-methylpyrazolidine.

Molecular Properties

Compound Name1-(2,4-dichlorophenyl)-2-methylpyrazolidine
PubChem CID59602826
Molecular FormulaC10H12Cl2N2
Molecular Weight231.13 g/mol
Exact Mass230.04
IUPAC Name1-(2,4-dichlorophenyl)-2-methylpyrazolidine
SMILESCN1CCCN1c1ccc(Cl)cc1Cl
InChIInChI=1S/C10H12Cl2N2/c1-13-5-2-6-14(13)10-4-3-8(11)7-9(10)12/h3-4,7H,2,5-6H2,1H3
InChIKeyTWEIAPGWWSCXCC-UHFFFAOYSA-N
XLogP3.05
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.13
LogP ≤ 53.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(3S)-1-(2,4-dichlorophenyl)-3-methylpiperazine
CID 24763526
1-(2,4-dichlorophenyl)-2,5-dimethylpyrrole
CID 4771829
2-(2,4-dichlorophenyl)-3-methyl-6,7,8,8a-tetrahydro-3H-pyrrolo[1,2-a]pyrazine-1,4-dione
CID 79944613
4-(2,4-dichlorophenyl)piperazine-1-carbaldehyde
CID 143237581
1-[7-(2,4-dichlorophenyl)-2-methyl-5,6-dihydro-4H-pyrazolo[3,4-b]pyridin-3-yl]ethanol
CID 59811519
2-(7-chloro-1-methyl-3,4-dihydro-2H-1,5-benzodiazepin-5-yl)ethanamine
CID 84629586
1-(2,4-dichlorophenyl)-N,2,3-trimethylpiperidin-4-amine
CID 79397447
7-(2,4-dichlorophenyl)-2-methyl-1,4,5,6-tetrahydropyrazolo[3,4-b]pyridin-3-one
CID 22136290
1-(4-chloro-2-iodophenyl)azepane
CID 107641046
1-[(2,4-dichlorophenyl)methyl]azetidine
CID 127007358
2-(4-chlorophenyl)-1-(2,4-dichlorophenyl)piperidine
CID 71176112
2-(2,4-dichlorophenyl)-3-methyl-3,4-dihydropyrazole-5-carboxylic acid
CID 143723671

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-dichlorophenyl)-2-methylpyrazolidine?
The IUPAC name of 1-(2,4-dichlorophenyl)-2-methylpyrazolidine (CID 59602826) is 1-(2,4-dichlorophenyl)-2-methylpyrazolidine.
What is the SMILES notation for 1-(2,4-dichlorophenyl)-2-methylpyrazolidine?
The canonical SMILES for 1-(2,4-dichlorophenyl)-2-methylpyrazolidine is CN1CCCN1c1ccc(Cl)cc1Cl.
What is the InChIKey of 1-(2,4-dichlorophenyl)-2-methylpyrazolidine?
The InChIKey is TWEIAPGWWSCXCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12Cl2N2/c1-13-5-2-6-14(13)10-4-3-8(11)7-9(10)12/h3-4,7H,2,5-6H2,1H3.
What are the key properties of 1-(2,4-dichlorophenyl)-2-methylpyrazolidine?
1-(2,4-dichlorophenyl)-2-methylpyrazolidine has a molecular weight of 231.13 g/mol, XLogP of 3.05, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-dichlorophenyl)-2-methylpyrazolidine is sourced from PubChem (CID 59602826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).