(4-methylindazol-1-yl)phosphane

C8H9N2P — CID 134575282

IUPAC(4-methylindazol-1-yl)phosphane
SMILESCc1cccc2c1cnn2P
InChIInChI=1S/C8H9N2P/c1-6-3-2-4-8-7(6)5-9-10(8)11/h2-5H,11H2,1H3
InChIKeyODEQBSFBDHXLBS-UHFFFAOYSA-N
MW164.15 g/mol
LogP1.98
Rot. Bonds

About (4-methylindazol-1-yl)phosphane

(4-methylindazol-1-yl)phosphane (PubChem CID 134575282) has the molecular formula C8H9N2P and a molecular weight of 164.15 g/mol. Its IUPAC name is (4-methylindazol-1-yl)phosphane.

Molecular Properties

Compound Name(4-methylindazol-1-yl)phosphane
PubChem CID134575282
Molecular FormulaC8H9N2P
Molecular Weight164.15 g/mol
Exact Mass164.05
IUPAC Name(4-methylindazol-1-yl)phosphane
SMILESCc1cccc2c1cnn2P
InChIInChI=1S/C8H9N2P/c1-6-3-2-4-8-7(6)5-9-10(8)11/h2-5H,11H2,1H3
InChIKeyODEQBSFBDHXLBS-UHFFFAOYSA-N
XLogP1.98
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.15
LogP ≤ 51.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

4-methyl-1-propan-2-ylindazole
CID 139297350
1,4-dimethylindazole;2,8-dimethyl-7-thia-8-azabicyclo[4.2.0]octa-1,3,5-triene;ethane
CID 164918721
1-methyl-4-[(4-methylindazol-1-yl)methyl]indazole
CID 168918626
4-methyl-1-(piperidin-4-ylmethyl)indazole
CID 84692855
1,5-dimethylnaphthalene
CID 162159355
CID 89301487
CID 89301487
5,9-dimethyl-3-phenylpyridazino[4,5-b]indol-4-one
CID 139892501
1-(3-fluoro-4-phenylmethoxyphenyl)-4-methylindazole
CID 71066878
N-(3-fluoro-4-methylphenyl)-4-methylindazole-1-carboxamide
CID 22510428
4-bromo-5-methyl-1-phenylindazole
CID 74888869
3,7-dimethylpyrazolo[1,5-a]pyridine
CID 142528331
4-methyl-N-[3-(trifluoromethyl)phenyl]indazole-1-carboxamide
CID 6623795

Frequently Asked Questions

What is the IUPAC name of (4-methylindazol-1-yl)phosphane?
The IUPAC name of (4-methylindazol-1-yl)phosphane (CID 134575282) is (4-methylindazol-1-yl)phosphane.
What is the SMILES notation for (4-methylindazol-1-yl)phosphane?
The canonical SMILES for (4-methylindazol-1-yl)phosphane is Cc1cccc2c1cnn2P.
What is the InChIKey of (4-methylindazol-1-yl)phosphane?
The InChIKey is ODEQBSFBDHXLBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N2P/c1-6-3-2-4-8-7(6)5-9-10(8)11/h2-5H,11H2,1H3.
What are the key properties of (4-methylindazol-1-yl)phosphane?
(4-methylindazol-1-yl)phosphane has a molecular weight of 164.15 g/mol, XLogP of 1.98, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methylindazol-1-yl)phosphane is sourced from PubChem (CID 134575282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).