4-chloro-1-[(4-chloro-3,5-dimethylpyrazol-1-yl)methyl]pyrazol-3-amine

C9H11Cl2N5 — CID 19618525

IUPAC4-chloro-1-[(4-chloro-3,5-dimethylpyrazol-1-yl)methyl]pyrazol-3-amine
SMILESCc1nn(Cn2cc(Cl)c(N)n2)c(C)c1Cl
InChIInChI=1S/C9H11Cl2N5/c1-5-8(11)6(2)16(13-5)4-15-3-7(10)9(12)14-15/h3H,4H2,1-2H3,(H2,12,14)
InChIKeyUCVNFGRMNWDIPB-UHFFFAOYSA-N
MW260.13 g/mol
LogP2.09
Rot. Bonds2

About 4-chloro-1-[(4-chloro-3,5-dimethylpyrazol-1-yl)methyl]pyrazol-3-amine

4-chloro-1-[(4-chloro-3,5-dimethylpyrazol-1-yl)methyl]pyrazol-3-amine (PubChem CID 19618525) has the molecular formula C9H11Cl2N5 and a molecular weight of 260.13 g/mol. Its IUPAC name is 4-chloro-1-[(4-chloro-3,5-dimethylpyrazol-1-yl)methyl]pyrazol-3-amine.

Molecular Properties

Compound Name4-chloro-1-[(4-chloro-3,5-dimethylpyrazol-1-yl)methyl]pyrazol-3-amine
PubChem CID19618525
Molecular FormulaC9H11Cl2N5
Molecular Weight260.13 g/mol
Exact Mass259.04
IUPAC Name4-chloro-1-[(4-chloro-3,5-dimethylpyrazol-1-yl)methyl]pyrazol-3-amine
SMILESCc1nn(Cn2cc(Cl)c(N)n2)c(C)c1Cl
InChIInChI=1S/C9H11Cl2N5/c1-5-8(11)6(2)16(13-5)4-15-3-7(10)9(12)14-15/h3H,4H2,1-2H3,(H2,12,14)
InChIKeyUCVNFGRMNWDIPB-UHFFFAOYSA-N
XLogP2.09
TPSA61.66 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.13
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-chloro-1-[(4-chloro-3,5-dimethylpyrazol-1-yl)methyl]pyrazol-3-amine 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

4-Chloro-1-[[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]methyl]pyrazol-3-amine
CID 19618528
1-((4-Chloro-1H-pyrazol-1-yl)methyl)-5-methyl-1H-pyrazol-3-amine
CID 19576695
1-[(4-chloro-1H-pyrazol-1-yl)methyl]-3,5-dimethyl-1H-pyrazol-4-amine
CID 19616935
4-Chloro-1-((1,3-dimethyl-1H-pyrazol-4-yl)methyl)-1H-pyrazol-5-amine
CID 7176036
1-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-1H-pyrazol-4-amine
CID 17024649
1-[(3,5-Dimethyl-1H-pyrazol-1-YL)methyl]-1H-pyrazol-3-amine
CID 19618518
1-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-1H-pyrazol-3-amine
CID 19618519
4-Chloro-1-[(3,5-dimethyl-1H-pyrazol-1-YL)methyl]-1H-pyrazol-3-amine
CID 19618524
1-[(4-Chloro-3,5-dimethylpyrazol-1-yl)methyl]-5-methylpyrazol-3-amine
CID 19618529
4-Chloro-3-methyl-1-[(1-methylpyrazol-4-yl)methyl]pyrazol-5-amine
CID 61734823
4-Chloro-3-methyl-1-[1-(1-methylpyrazol-4-yl)ethyl]pyrazol-5-amine
CID 61792487
4-Chloro-1-[1-(1,3,5-trimethylpyrazol-4-yl)ethyl]pyrazol-5-amine
CID 61890873

Frequently Asked Questions

What is the IUPAC name of 4-chloro-1-[(4-chloro-3,5-dimethylpyrazol-1-yl)methyl]pyrazol-3-amine?
The IUPAC name of 4-chloro-1-[(4-chloro-3,5-dimethylpyrazol-1-yl)methyl]pyrazol-3-amine (CID 19618525) is 4-chloro-1-[(4-chloro-3,5-dimethylpyrazol-1-yl)methyl]pyrazol-3-amine.
What is the SMILES notation for 4-chloro-1-[(4-chloro-3,5-dimethylpyrazol-1-yl)methyl]pyrazol-3-amine?
The canonical SMILES for 4-chloro-1-[(4-chloro-3,5-dimethylpyrazol-1-yl)methyl]pyrazol-3-amine is Cc1nn(Cn2cc(Cl)c(N)n2)c(C)c1Cl.
What is the InChIKey of 4-chloro-1-[(4-chloro-3,5-dimethylpyrazol-1-yl)methyl]pyrazol-3-amine?
The InChIKey is UCVNFGRMNWDIPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11Cl2N5/c1-5-8(11)6(2)16(13-5)4-15-3-7(10)9(12)14-15/h3H,4H2,1-2H3,(H2,12,14).
What are the key properties of 4-chloro-1-[(4-chloro-3,5-dimethylpyrazol-1-yl)methyl]pyrazol-3-amine?
4-chloro-1-[(4-chloro-3,5-dimethylpyrazol-1-yl)methyl]pyrazol-3-amine has a molecular weight of 260.13 g/mol, XLogP of 2.09, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-1-[(4-chloro-3,5-dimethylpyrazol-1-yl)methyl]pyrazol-3-amine is sourced from PubChem (CID 19618525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).