(4-chloro-1-propan-2-ylpyrazol-5-yl)methylhydrazine

C7H13ClN4 — CID 105220837

IUPAC(4-chloro-1-propan-2-ylpyrazol-5-yl)methylhydrazine
SMILESCC(C)n1ncc(Cl)c1CNN
InChIInChI=1S/C7H13ClN4/c1-5(2)12-7(4-10-9)6(8)3-11-12/h3,5,10H,4,9H2,1-2H3
InChIKeyFHKRXKSKJNTCJA-UHFFFAOYSA-N
MW188.66 g/mol
LogP1.08
Rot. Bonds3

About (4-chloro-1-propan-2-ylpyrazol-5-yl)methylhydrazine

(4-chloro-1-propan-2-ylpyrazol-5-yl)methylhydrazine (PubChem CID 105220837) has the molecular formula C7H13ClN4 and a molecular weight of 188.66 g/mol. Its IUPAC name is (4-chloro-1-propan-2-ylpyrazol-5-yl)methylhydrazine.

Molecular Properties

Compound Name(4-chloro-1-propan-2-ylpyrazol-5-yl)methylhydrazine
PubChem CID105220837
Molecular FormulaC7H13ClN4
Molecular Weight188.66 g/mol
Exact Mass188.08
IUPAC Name(4-chloro-1-propan-2-ylpyrazol-5-yl)methylhydrazine
SMILESCC(C)n1ncc(Cl)c1CNN
InChIInChI=1S/C7H13ClN4/c1-5(2)12-7(4-10-9)6(8)3-11-12/h3,5,10H,4,9H2,1-2H3
InChIKeyFHKRXKSKJNTCJA-UHFFFAOYSA-N
XLogP1.08
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.66
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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

N-[(4-chloro-1-propan-2-ylpyrazol-5-yl)methyl]cyclopropanamine
CID 114652139
4-chloro-5-ethyl-1-propan-2-ylpyrazole;ethane
CID 177038898
3-(4-chloro-1-propan-2-ylpyrazol-5-yl)-N-methylpropan-1-amine
CID 114663927
[1-(4-chloro-1-propan-2-ylpyrazol-5-yl)-2,2-dimethoxyethyl]hydrazine
CID 105246185
[1-(4-chloro-1-propan-2-ylpyrazol-5-yl)-3-ethoxypropyl]hydrazine
CID 105336873
[1-(4-chloro-1-propan-2-ylpyrazol-5-yl)-2-methoxy-2-methylpropyl]hydrazine
CID 105245533
1-(4-chloro-1-propan-2-ylpyrazol-5-yl)-2-ethoxypropan-1-amine
CID 114652830
1-(4-chloro-1-propan-2-ylpyrazol-5-yl)-2-ethoxyethanamine
CID 114655949
2-(4-chloro-1-propan-2-ylpyrazol-5-yl)-2,2-difluoroethanamine
CID 115034214
1-(4-chloro-1-propan-2-ylpyrazol-5-yl)-2-methylbutan-1-ol
CID 114635180
1-(4-chloro-1-propan-2-ylpyrazol-5-yl)-2-ethoxy-2-methylbutan-1-amine
CID 114661599
2-amino-1-(4-chloro-1-propan-2-ylpyrazol-5-yl)-2-ethylbutan-1-one
CID 114670309

Frequently Asked Questions

What is the IUPAC name of (4-chloro-1-propan-2-ylpyrazol-5-yl)methylhydrazine?
The IUPAC name of (4-chloro-1-propan-2-ylpyrazol-5-yl)methylhydrazine (CID 105220837) is (4-chloro-1-propan-2-ylpyrazol-5-yl)methylhydrazine.
What is the SMILES notation for (4-chloro-1-propan-2-ylpyrazol-5-yl)methylhydrazine?
The canonical SMILES for (4-chloro-1-propan-2-ylpyrazol-5-yl)methylhydrazine is CC(C)n1ncc(Cl)c1CNN.
What is the InChIKey of (4-chloro-1-propan-2-ylpyrazol-5-yl)methylhydrazine?
The InChIKey is FHKRXKSKJNTCJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13ClN4/c1-5(2)12-7(4-10-9)6(8)3-11-12/h3,5,10H,4,9H2,1-2H3.
What are the key properties of (4-chloro-1-propan-2-ylpyrazol-5-yl)methylhydrazine?
(4-chloro-1-propan-2-ylpyrazol-5-yl)methylhydrazine has a molecular weight of 188.66 g/mol, XLogP of 1.08, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-chloro-1-propan-2-ylpyrazol-5-yl)methylhydrazine is sourced from PubChem (CID 105220837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).