4-(aminomethyl)-1-(3-chlorophenyl)pyrazol-5-amine

C10H11ClN4 — CID 115069399

IUPAC4-(aminomethyl)-1-(3-chlorophenyl)pyrazol-5-amine
SMILESNCc1cnn(-c2cccc(Cl)c2)c1N
InChIInChI=1S/C10H11ClN4/c11-8-2-1-3-9(4-8)15-10(13)7(5-12)6-14-15/h1-4,6H,5,12-13H2
InChIKeyPMGNWLOOBKZXCU-UHFFFAOYSA-N
MW222.68 g/mol
LogP1.57
Rot. Bonds2

About 4-(aminomethyl)-1-(3-chlorophenyl)pyrazol-5-amine

4-(aminomethyl)-1-(3-chlorophenyl)pyrazol-5-amine (PubChem CID 115069399) has the molecular formula C10H11ClN4 and a molecular weight of 222.68 g/mol. Its IUPAC name is 4-(aminomethyl)-1-(3-chlorophenyl)pyrazol-5-amine.

Molecular Properties

Compound Name4-(aminomethyl)-1-(3-chlorophenyl)pyrazol-5-amine
PubChem CID115069399
Molecular FormulaC10H11ClN4
Molecular Weight222.68 g/mol
Exact Mass222.07
IUPAC Name4-(aminomethyl)-1-(3-chlorophenyl)pyrazol-5-amine
SMILESNCc1cnn(-c2cccc(Cl)c2)c1N
InChIInChI=1S/C10H11ClN4/c11-8-2-1-3-9(4-8)15-10(13)7(5-12)6-14-15/h1-4,6H,5,12-13H2
InChIKeyPMGNWLOOBKZXCU-UHFFFAOYSA-N
XLogP1.57
TPSA69.86 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.68
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[1-(3-chlorophenyl)-5-cyclopropylpyrazol-4-yl]methanamine
CID 66441286
4-(aminomethyl)-1-[3-(trifluoromethyl)phenyl]pyrazol-5-amine
CID 115069398
2-[1-(3-chlorophenyl)-5-methylpyrazol-4-yl]ethanamine
CID 82291485
[1-(3-bromophenyl)-5-chloropyrazol-4-yl]methanamine
CID 115052372
[1-(3-chlorophenyl)-5-propan-2-ylpyrazol-4-yl]methanol
CID 66437016
[1-(3-chlorophenyl)-5-propylpyrazol-4-yl]methanol
CID 66437018
2-[1-(3-chlorophenyl)-5-methoxypyrazol-4-yl]acetic acid
CID 115069043
2-[5-amino-1-(4-chlorophenyl)pyrazol-4-yl]acetic acid
CID 115069490
1-(3-chlorophenyl)-5-cyclopropylpyrazol-4-amine
CID 66423941
6-chloro-1-(3-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-amine
CID 82460127
N'-[1-(3-chlorophenyl)-5-phenylpyrazol-4-yl]ethane-1,2-diamine
CID 117210691
[4-[1-(3-chlorophenyl)tetrazol-5-yl]phenyl]methanamine
CID 82228168

Frequently Asked Questions

What is the IUPAC name of 4-(aminomethyl)-1-(3-chlorophenyl)pyrazol-5-amine?
The IUPAC name of 4-(aminomethyl)-1-(3-chlorophenyl)pyrazol-5-amine (CID 115069399) is 4-(aminomethyl)-1-(3-chlorophenyl)pyrazol-5-amine.
What is the SMILES notation for 4-(aminomethyl)-1-(3-chlorophenyl)pyrazol-5-amine?
The canonical SMILES for 4-(aminomethyl)-1-(3-chlorophenyl)pyrazol-5-amine is NCc1cnn(-c2cccc(Cl)c2)c1N.
What is the InChIKey of 4-(aminomethyl)-1-(3-chlorophenyl)pyrazol-5-amine?
The InChIKey is PMGNWLOOBKZXCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11ClN4/c11-8-2-1-3-9(4-8)15-10(13)7(5-12)6-14-15/h1-4,6H,5,12-13H2.
What are the key properties of 4-(aminomethyl)-1-(3-chlorophenyl)pyrazol-5-amine?
4-(aminomethyl)-1-(3-chlorophenyl)pyrazol-5-amine has a molecular weight of 222.68 g/mol, XLogP of 1.57, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-1-(3-chlorophenyl)pyrazol-5-amine is sourced from PubChem (CID 115069399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).